added Genetic Algorythm code in branch feature-ga

diff --git a/.gitignore b/.gitignore
new file mode 100644 (file)
index 0000000..b2a5628
--- /dev/null
+++ b/.gitignore
@@ -0,0 +1,2 @@
+*.swp
+source/ga/build

diff --git a/doc/unresga.1 b/doc/unresga.1
new file mode 100644 (file)
index 0000000..295dca6
--- /dev/null
+++ b/doc/unresga.1
@@ -0,0 +1,70 @@
+.TH unresga 1    "September 26, 2011" "version 0.1" "USER COMMANDS"
+.SH NAME
+unresga \- finds optimal parameters for UNRES force-field by using genetic algorithm (GA)
+.SH SYNOPSIS
+.B unresga
+.SH DESCRIPTION
+This utility optimizes UNRES force-fields parameters (weights) by using genetic algorithm.
+Curentely there are 19 parameters that can be optimized, altough not all of them are used (WLONG for instance).
+These paremeters are defined in thó MD inputs as WLONG, WSCP, WELEC, WBOND, WANG, WSCLOC, WTOR, WTORD, WCORRH, WCORR4, WCORR5, WCORR6, WEL_LOC, WTURN3, WTURN4, WTURN6, WVDWPP, WHPB, WSCCOR.
+The min and max boundries for these parameters are defined in the 
+.I src/GA.inc
+file.
+
+
+.SH FILES
+.IP unresga.inp 
+This is the main configuration file 
+.IP unresga.log 
+This is the automaticly generated log file. Use it for troubleshooting.
+.IP unresga.state 
+state file used by the main program to manage input generation between MREMD, WHAM, ZSCORE steps. You shouldn't modify it unless something went terrible wrong and you realy know what you are doing...
+
+.SH unresga.inp structure
+The 
+.I unresga.inp
+file consists of 
+.B key=value1 value2 ... valueX
+entries. Key entries must be uppercase or lowercase, but not mixed-type. An example input file should look like this:   
+
+.nf
+pdb=1LE1.pdb 1L2Y.pdb
+.br
+alg=csa
+.br
+generations=50 
+.br
+cicutoff=5.0
+.br
+population=4
+.br
+whamtemplate=1LE1_wham.tpl 1L2Y_wham.tpl
+.br
+mremdtemplate=1LE1_mremd.tpl 1L2Y_mremd.tpl
+.br
+scripts=startwham.mat startmremd.mat
+.fi
+
+.IP PDB= 
+Posible values are the reference PDB files used for calculations. At least one file should be specified. Maximum number of PDB files is set by variable maxnpdb in 
+.I src/common.inc
+(default 10)
+.IP ALG=
+Value defines witch algoritm should be used in genetic part. Values are: simple, better, betterv2, csa, cluster. 
+.IP GENERATIONS=
+Value sets maximum number of iterations for the genetic algorithm part.
+.IP POPULATION=
+Sets the size of bank population. Actual size of population is this value multiplied by value of the BANK_MULTIPLIER constant set in 
+.I src/GA.inc
+(default 4) 
+.IP WHAMTEMPLATE=
+Set the input template for generationg WHAM inputs. Number of templates should be equal to the number of PDB files.
+.IP MREMDTEMPLATE=
+Same as above but for MREMD inputs.  
+
+.IP SCRIPTS=
+Copy aditional files (shell scripts) for current input. This is obsolete and curentely disabled. 
+
+
+.SH AUTHOR
+Dawid Jagiela  (lightnir (at) chem.univ.gda.pl)

diff --git a/source/ga/GA.f b/source/ga/GA.f
new file mode 100644 (file)
index 0000000..8e2225d
--- /dev/null
+++ b/source/ga/GA.f
@@ -0,0 +1,1663 @@
+      program unresag
+      
+      implicit none
+      include 'GA.inc'
+      include 'common.inc'
+      include 'io.inc'
+      real*16 :: WEIGHTS(18)
+      integer*4 :: i,j,m,n,iloc,pos,iter,maxiter,numarg,tmplen
+      integer*4 :: WybierzOsobnika,Najlepszy,ZnajdzPodobnego,FindWorst
+      integer*4 :: status
+      integer*4 :: mnoznik = 10
+      character*16 :: mode,argn,argi,dir_nam
+      character*15 :: filename
+      real*8 :: loc,fc,sumfitness,sump,avrp,maxfc
+      real :: rand, r
+      real*8 :: maxfcever
+      real*8 :: FunkcjaCeluB, FunkcjaCeluB2, FunkcjaCeluR
+c      character*500 :: Weights2Str
+      character(80),dimension(5) :: wagi
+      logical :: searching = .false.
+      logical :: logdata = .true.
+      logical :: fileex = .false.
+      logical :: retry = .false.
+      logical :: dir_ex = .false. 
+      logical :: debug = .true.
+      character*200 :: text, tmptext,tmptext2
+      character(len=*), parameter :: FMT = "(19F10.5,E15.7,F10.5)"
+c      character(len=*), parameter :: FMT = "(F10.5,F10.5,F10.5,F10.5,F10&
+c     &.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10.5,F10&
+c     &.5,F10.5,F10.5,F10.5,F10.5,F10.5)"
+      
+c =======================================================================
+c  Main program
+c =======================================================================
+
+
+      call ReadInput(status)
+      if ((maxminstep.gt.0).and.(generation.eq.1)) then
+c Do first score  
+       do_fs=.true.
+      endif
+c  Is everything  OK?
+      if (status.gt.0) then
+       write(*,*) "There ware input file errors - check log."
+       goto 2010
+      endif
+
+      call itime(timeArray)
+      r = rand(timeArray(1)*10000+timeArray(2)*100+timeArray(3))
+c     Fair enough?
+c      r = 527865426
+
+
+c-------------------------------------------------------
+c bank & populacja arrays store this   
+c 1-19 - weights
+c   20 - energy obtained from zscore
+c   21 - fittness 
+c-------------------------------------------------------
+      allocate (bank(banksize,21))
+      allocate (populacja(BANK_MULTIPLIER*banksize,21))
+      allocate (pairs(BANK_MULTIPLIER*banksize))
+c
+c Zero the arrays
+c
+      do i=1,BANK_MULTIPLIER*banksize
+       do j=1,21
+        populacja(i,j)=0
+       enddo
+       pairs(i)=0
+      enddo
+      do i=1,banksize
+       do j=1,21
+       bank(i,j)=0
+       enddo
+      enddo
+
+c First time here?
+      inquire(FILE=ostatefn,EXIST=fileex)
+c No. Prepere next generation
+      if (fileex) then
+       open(ostate,file=ostatefn) 
+       read(ostate,'(I4)') generation
+       read(ostate,'(L2)') do_optima
+       read(ostate,'(L2)') do_ga 
+       close(ostate)
+       if (do_ga) then
+        call write2log("Doing GA in this step")
+       endif
+       if (.not.do_optima) then
+        maxminstep=0
+        call write2log("ZSCORE weights minimalization disabled for now")
+        generation=generation+1
+       endif
+
+       call ReadOptimaW(BANK_MULTIPLIER*banksize,populacja)
+
+c Yes. Generate random zero-population
+      else
+       call GenPopulation(BANK_MULTIPLIER*banksize,populacja)
+       if (do_optima) then
+        do_ga=.false.
+       endif 
+
+c End of "fisrst time here?" code
+      endif
+
+c
+c Do we actual use a Genetic Algorithm?
+c
+
+      if (do_ga.eq..true.) then
+
+c Yes. This is only done when doing second pass with ZSCORE (without weight minimalizaton)
+c or with weight minimalization disabled (maxmin=0) just to obtain final score)
+
+c \\---//================================================================
+c  \\-//           
+c   "//  Genetic Algorithm code starts here  
+c   //-\\                                        
+c =//---\\===============================================================
+
+      call ReadZEnergy(BANK_MULTIPLIER*banksize,populacja)
+      do i=1,BANK_MULTIPLIER*banksize
+c       populacja(i,20)=FunkcjaCeluR(populacja(i,20))
+       write(*,*) "Ind ",i,populacja(i,20)
+      enddo
+
+      call write2log("==[ Doing GA now ]=============================")
+
+c
+c Populate bank depending on algorithm
+c
+      select case(alg)
+       case('simple')
+        call GetNBest(populacja,bank,banksize)
+       case('better')
+        call GetNBest(populacja,bank,banksize)
+       case('betterv2')
+        call GetNBest(populacja,bank,banksize)
+       case('csa')
+c --- debug begin ---
+       if (debug) then
+        write(*,*) "generation: ",generation
+        write(*,*) "maxminstep: ",maxminstep
+        write(*,*) "do_ga: ",do_ga
+        write(*,*) "do_optima: ",do_optima
+        write(*,*) "do_fs: ",do_fs
+        write(*,*) "cicutoff: ", cicutoff         
+       endif
+c --- debug end ---
+
+        csacutoff=cicutoff
+
+c
+c  Fill the bank just after the first time we get the score 
+c
+        if (((generation.eq.2).and.(maxminstep.eq.0)).or.((generation.eq&
+     &.2).and.(maxminstep.gt.0))) then
+
+c --- debug begin ---
+        if (debug) then 
+         write(*,*) "Calling GetNBest..."
+        endif
+c --- debug end ---
+         call GetNBest(populacja,bank,banksize)
+c --- debug begin ---
+        if (debug) then
+         do i=1,banksize
+          write(*,FMT) bank(i,:)
+         enddo
+        endif
+c --- debug end ---
+
+         call CalcFitness(bank,sumfitness)
+         call WriteBank(bank)  
+
+c
+c Do normal CSA
+c        
+        else
+
+c --- debug begin ---
+        if (debug) then 
+         write(*,*) "Szukam podobnego"
+        endif
+c --- debug end ---
+
+         call ReadBank(bank)
+
+         do i=1,BANK_MULTIPLIER*banksize
+          write(tmptext,'(I4)') i
+          call write2log("Checking ind "//tmptext)  
+          j=ZnajdzPodobnego(banksize,bank,populacja(i,:),csacutoff)
+          if (j.gt.0) then
+           if (populacja(i,20).lt.bank(j,20)) then
+            write(tmptext,'(I4)') j
+            write(tmptext2,'(I4)') i
+            call write2log("Swaping ind"//trim(tmptext)//" from bank to &
+     &ind "//trim(tmptext2)//" from population")
+            bank(j,:)=populacja(i,:)
+           endif
+          else
+           j=FindWorst(banksize,bank)
+           write(tmptext,'(I4)') j
+           write(tmptext2,'(I4)') i
+           if (populacja(i,20).lt.bank(j,20)) then
+            call write2log("Worst in bank is "//trim(tmptext))
+            call write2log("Swaping worst ind in bank to "//trim(tmptext&
+     &2))
+            bank(j,:)=populacja(i,:)
+           endif
+          endif
+         enddo
+
+c -----------------------------------------------------------------------
+c      Calculate fitness for reproduction
+c -----------------------------------------------------------------------
+          call CalcFitness(bank,sumfitness)
+
+c --- debug begin ---
+       if (debug) then
+        write (*,*) "Dumping bank: "        
+        do i=1,banksize
+         write(*,FMT) bank(i,:)
+        enddo
+        write (*,*) "Sumfitness: ", sumfitness   
+       endif
+c --- debug end ---
+
+         call WriteBank(bank)
+         csacutoff=csacutoff-(cicutoff/maxgen)
+c       csacutoff=cicutoff*(0.8**(iter-1))
+
+         write(tmptext,'(F7.5)') csacutoff
+
+         call write2log("CSA cutoff is now set to "//tmptext)
+        endif
+       case('cluster')
+        write(*,*) "Some stuff here in the future"
+        goto 2010
+      end select
+
+c      call WritePopSum()
+
+
+c Have we done last generation ?
+      if (generation.eq.maxgen) then 
+       call write2log("Maximum number of genarations reached. QUITING.")
+       goto 2010
+      endif
+c Prapering for  next generation so increase counter 
+        iter=iter+1
+ 
+c -----------------------------------------------------------------------
+c      Reproduction
+c -----------------------------------------------------------------------
+      call write2log("==[ Reproducting ]============================")
+      select case(alg)
+       case('simple','csa')
+        do i=1,BANK_MULTIPLIER*banksize
+        m=WybierzOsobnika(banksize,bank)
+        write(tmptext,'(I4)') m
+        write(tmptext2,'(I4)') i
+        call write2log("Reproducting individual "//trim(tmptext)//" from&
+     & bank as new individual "//trim(tmptext2))
+        populacja(i,:)=bank(m,:)
+        end do
+       case('better','betterv2')
+        populacja(1,:)=bank(1,:)
+        call write2log("Reproducting first (best) individual")
+        do i=2,BANK_MULTIPLIER*banksize
+        m=WybierzOsobnika(banksize,bank)
+        write(tmptext,'(I4)') m
+        write(tmptext2,'(I4)') i
+        call write2log("Reproducting individual "//trim(tmptext)//" from&
+     & bank as new individual "//trim(tmptext2))
+        populacja(i,:)=bank(m,:)
+        end do
+      end select
+
+c -----------------------------------------------------------------------
+c      Pairing
+c -----------------------------------------------------------------------
+      do i=1,BANK_MULTIPLIER*banksize
+       pairs(i)=0
+      end do
+      
+      do i=1,BANK_MULTIPLIER*banksize
+       if (pairs(i).eq.0) then
+210     pos=1+int(rand(0)/(1/real(BANK_MULTIPLIER*banksize)))
+        if (pos.le.i) then
+         goto 210
+        endif
+        do j=1,(i-1)
+         if (pairs(j).eq.pos) then
+          goto 210
+         endif
+        end do
+        pairs(i) = pos
+        pairs(pos) = i
+       endif
+      end do  
+      call write2log("==[ Pairing ]==============================")
+      do i=1,BANK_MULTIPLIER*banksize
+       write(tmptext,'(A11,I3.3,A5,I3.3,A21)') "Individual ",i," and ",p&
+     &airs(i)," will be crossed over"
+       call write2log(trim(tmptext))
+      end do
+
+c -----------------------------------------------------------------------
+c      Crossover
+c -----------------------------------------------------------------------
+      call write2log("==[ Crossing ]==============================")
+      do i=1,BANK_MULTIPLIER*banksize
+       if (pairs(i) .gt. i) then
+        call CrossoverS(populacja(i,:),populacja(pairs(i),:))
+       endif
+      end do
+       
+      
+       call write2log("         WLONG   WSCP    WELEC   WBOND   WANG    &
+     &WSCLOC  WTOR    WTORD   WCORRH  WCORR4  WCORR5  WCORR6  WEL_LOC WT&
+     &URN3  WTURN4  WTURN6  WVDWPP  WHPB    WSCCOR")
+      do i=1,BANK_MULTIPLIER*banksize
+       tmplen = 9
+       text = ""
+       write(text,'(A4,I3.3,A2)') "Ind",i,": "
+       do j=1,19
+        write(tmptext,'(F7.5)') populacja(i,j)
+        text =  text(1:tmplen) // tmptext
+        tmplen = tmplen + 8
+       end do
+       call write2log(trim(text))
+      end do
+
+c -----------------------------------------------------------------------
+c      Mutation
+c -----------------------------------------------------------------------
+
+      call write2log("==[ Mutating ]==============================") 
+      do i = 1,19
+       if (IGNORE_WEIGHT(i).eq.1) then
+        write(tmptext,'(I2)') i
+        call write2log("Parameter "//trim(WNAME(i))//" will be ignored")
+       endif
+      end do  
+      do i=1,BANK_MULTIPLIER*banksize
+       call MutationV(populacja(i,:),i,MUTRATIO)
+      end do
+c for betterv2 and csa restore best individual
+      select case(alg)
+       case('betterv2','csa')
+       populacja(1,:)=bank(1,:)
+      end select
+
+c
+c Genetic Algorithm blokcode stops here
+c
+      endif
+
+c ---------------------------------
+c  Do some final stuff 
+c ---------------------------------
+c
+c Set the variables before writing to state file 
+c
+      if ((.not.do_ga).and.(.not.do_optima)) then
+       if (do_fs) then
+        do_ga=.false.
+        do_optima=.true.
+       else
+        do_ga=.true.
+        do_optima=.false.
+       endif
+      else
+       if (do_fs) then
+        do_optima=.not.do_optima
+        if (generation.eq.1) then
+         do_ga=.false.
+        else
+         do_ga=.not.do_ga
+        endif
+       else
+        do_ga=.true.
+        do_optima=.false.
+       endif 
+      endif
+
+
+c
+c Write te current state and population
+c
+      call WriteState()
+c      call WritePopSum()
+c
+c Create the inputs
+c 
+      write(tmptext,'(I)') generation
+      call write2log("Preparing inputs for generation "//trim(adjustl(tm&
+     &ptext)))
+      call CreateInputs(BANK_MULTIPLIER*banksize,populacja)
+c
+c All done? Then let's quit.
+c
+      goto 2010
+
+
+
+c ======================================================================
+c
+c    MAIN CODE ENDS HERE
+c
+c ======================================================================
+
+
+
+2000  deallocate(populacja)
+      deallocate(pairs)
+2010  end program
+
+
+c ======================================================================
+c  Clustering subroutines
+c ======================================================================
+
+      include 'cluster.inc'
+
+
+c ======================================================================
+c  Write2log subroutine
+c ======================================================================
+c  Creates logs  
+c ----------------------------------------------------------------------
+
+      subroutine Write2log(text)
+       include 'common.inc'
+       include 'io.inc'
+       character*200 :: tmptext
+       character(len=*) :: text
+       logical :: ex
+       call itime(timeArray)
+       inquire(file=ologfn,exist=ex)
+       if (.not.ex) then
+       open(olog, file=ologfn, access="append")
+       write(olog,"(A)") "==============================================&
+     &=========="
+       tmptext = "= UNRES weights optimizer version "//version 
+       write(olog,"(A)") tmptext
+       write(olog,"(A)") info
+       write(olog,"(A)") "==============================================&
+     &=========="
+       close(olog)
+       endif
+       open(olog, file = ologfn , access = "append")
+       write(olog,"(I2.2,A1,I2.2,A1,I2.2,A2,A)") timeArray(1),":",timeAr&
+     &ray(2),":",timeArray(3),": ",text
+       close(olog)
+      end subroutine Write2log
+
+c ======================================================================
+c  GetNBest subroutine
+c ======================================================================
+c Fills up the bank population up to banksize with individuals from
+c inputpop heving the best(lowest) score
+c ----------------------------------------------------------------------
+
+      subroutine GetNBest(inputpop,bank,banksize)
+       integer*4 :: banksize, i,j,idx
+       real*8 :: inputpop, bank, best, last
+       include 'GA.inc'
+       dimension inputpop(banksize*BANK_MULTIPLIER,21)
+       dimension bank(banksize,21)
+       
+       last=0.0
+       idx=1
+       do j=1,banksize
+       best=100000000000000000.0
+        do i=1,banksize*BANK_MULTIPLIER
+         if ((inputpop(i,20).lt.best).and.(inputpop(i,20).gt.last)) then
+          best=inputpop(i,20)
+          idx=i
+         endif
+        end do
+        bank(j,:)=inputpop(idx,:)
+        last=best
+       end do
+      end subroutine GetNBest
+
+c ======================================================================
+c  FindWorst subroutine
+c ======================================================================
+c  Finds the worst (highest score) individual in population
+c ----------------------------------------------------------------------
+
+      integer*4 function FindWorst(rozmiar,pop)
+       integer*4 :: rozmiar, i, idx
+       real*16 :: pop,last
+       dimension pop(rozmiar,21)
+       
+       last=0.0
+       idx = 0
+       do i=1,rozmiar
+        if (pop(i,20).gt.last) then
+         idx = i
+         last=pop(i,20)
+        endif
+       end do
+       FindWorst=idx
+       return
+      end function
+
+c ======================================================================
+c  GenPopulation subroutine
+c ======================================================================
+c  Generates a population (pop) of nind individuals with 19 random 
+c  wights from a set of ranges (see GA.inc).
+c ----------------------------------------------------------------------
+
+      subroutine GenPopulation(nind,pop)
+       integer*4 :: i,j,nind
+       real*8 :: pop
+       dimension pop(nind,21) 
+       include 'GA.inc'
+       do j=1,nind
+        do i=1,19
+         select case(i)
+          case (1)
+           pop(j,1)=WLONG_LOW+(rand(0)*(WLONG_HI-WLONG_LOW))
+          case (2)
+           pop(j,2)=WSCP_LOW+(rand(0)*(WSCP_HI-WSCP_LOW))
+          case (3)
+           pop(j,3)=WELEC_LOW+(rand(0)*(WELEC_HI-WELEC_LOW))
+          case (4)
+           pop(j,4)=WBOND_LOW+(rand(0)*(WBOND_HI-WBOND_LOW))
+          case (5)
+           pop(j,5)=WANG_LOW+(rand(0)*(WANG_HI-WANG_LOW))
+          case (6)
+           pop(j,6)=WSCLOC_LOW+(rand(0)*(WSCLOC_HI-WSCLOC_LOW))
+          case (7)
+           pop(j,7)=WTOR_LOW+(rand(0)*(WTOR_HI-WTOR_LOW))
+          case (8)
+           pop(j,8)=WTORD_LOW+(rand(0)*(WTORD_HI-WTORD_LOW))
+          case (9)
+           pop(j,9)=WCORRH_LOW+(rand(0)*(WCORRH_HI-WCORRH_LOW))
+          case (10)
+           pop(j,10)=WCORR4_LOW+(rand(0)*(WCORR4_HI-WCORR4_LOW))
+          case (11)
+           pop(j,11)=WCORR5_LOW+(rand(0)*(WCORR5_HI-WCORR5_LOW))
+          case (12)
+           pop(j,12)=WCORR6_LOW+(rand(0)*(WCORR6_HI-WCORR6_LOW))
+          case (13)
+           pop(j,13)=WEL_LOC_LOW+(rand(0)*(WEL_LOC_HI-WEL_LOC_LOW))
+          case (14)
+           pop(j,14)=WTURN3_LOW+(rand(0)*(WTURN3_HI-WTURN3_LOW))
+          case (15)
+           pop(j,15)=WTURN4_LOW+(rand(0)*(WTURN4_HI-WTURN4_LOW))
+          case (16)
+           pop(j,16)=WTURN6_LOW+(rand(0)*(WTURN6_HI-WTURN6_LOW))
+          case (17)
+           pop(j,17)=WVDWPP_LOW+(rand(0)*(WVDWPP_HI-WVDWPP_LOW))
+          case (18)
+           pop(j,18)=WHPB_LOW+(rand(0)*(WHPB_HI-WHPB_LOW))
+          case (19)
+           pop(j,19)=WSCCOR_LOW+(rand(0)*(WSCCOR_HI-WSCCOR_LOW))
+         end select
+        end do
+       end do
+      end subroutine GenPopulation
+     
+c ======================================================================
+c  CrossoverS subroutine
+c ======================================================================
+c  Does a simple value crossing-over on a pair
+c  of two given individuals, giving two new individuals.
+c ----------------------------------------------------------------------
+
+      subroutine CrossoverS(ind1,ind2)
+       real*8 :: ind1(19),ind2(19),temp(19)
+       integer*4 :: loc
+       loc = 1 + int(rand(0)/(1/18.0))
+c       write (*,*) "Krzyzowanie pomiedzy pozycja ",(loc-1),"a",loc
+       temp = ind2
+       do i=(loc),19
+        ind2(i)=ind1(i)
+        ind1(i)=temp(i)
+       end do 
+      end subroutine CrossoverS
+     
+c ======================================================================
+c  MutationV subroutine
+c ======================================================================
+c  Does a value mutation for the given individual (ind) with the 
+c  given mutation ratio (mratio).
+c ----------------------------------------------------------------------
+
+      subroutine MutationV(ind,id,mratio)
+       include 'GA.inc'
+c       real*8 :: rand
+       real :: mratio
+       real*8 :: ind(19),ti
+       integer*4 :: i,id
+       character*100 :: tmptext
+       character*150 :: logtext
+       
+       do i = 1,19
+        if (IGNORE_WEIGHT(i).eq.1) then
+c            write(tmptext,'(I2)') i
+c          call write2log("Skipping weight "//trim(tmptext))
+            goto 2300
+        endif 
+        if (rand(0)<mratio) then
+          select case(i)
+            case (1)
+             ti=ind(1)
+             ind(1)=WLONG_LOW+(rand(0)*(WLONG_HI-WLONG_LOW))
+            case (2)
+             ti=ind(2)
+             ind(2)=WSCP_LOW+(rand(0)*(WSCP_HI-WSCP_LOW))
+            case (3)
+             ti=ind(3)
+             ind(3)=WELEC_LOW+(rand(0)*(WELEC_HI-WELEC_LOW))
+            case (4)
+             ti=ind(4)
+             ind(4)=WBOND_LOW+(rand(0)*(WBOND_HI-WBOND_LOW))
+            case (5)
+             ti=ind(5)
+             ind(5)=WANG_LOW+(rand(0)*(WANG_HI-WANG_LOW))
+            case (6)
+             ti=ind(6)
+             ind(6)=WSCLOC_LOW+(rand(0)*(WSCLOC_HI-WSCLOC_LOW))
+            case (7)
+             ti=ind(7)
+             ind(7)=WTOR_LOW+(rand(0)*(WTOR_HI-WTOR_LOW))
+            case (8)
+             ti=ind(8)
+             ind(8)=WTORD_LOW+(rand(0)*(WTORD_HI-WTORD_LOW))
+            case (9)
+             ti=ind(9)
+             ind(9)=WCORRH_LOW+(rand(0)*(WCORRH_HI-WCORRH_LOW))
+            case (10)
+             ti=ind(10)
+             ind(10)=WCORR4_LOW+(rand(0)*(WCORR4_HI-WCORR4_LOW))
+            case (11)
+             ti=ind(11)
+             ind(11)=WCORR5_LOW+(rand(0)*(WCORR5_HI-WCORR5_LOW))
+            case (12)
+             ti=ind(12)
+             ind(12)=WCORR6_LOW+(rand(0)*(WCORR6_HI-WCORR6_LOW))
+            case (13)
+             ti=ind(13)
+             ind(13)=WEL_LOC_LOW+(rand(0)*(WEL_LOC_HI-WEL_LOC_LOW))
+            case (14)
+             ti=ind(14)
+             ind(14)=WTURN3_LOW+(rand(0)*(WTURN3_HI-WTURN3_LOW))
+            case (15)
+             ti=ind(15)
+             ind(15)=WTURN4_LOW+(rand(0)*(WTURN4_HI-WTURN4_LOW))
+            case (16)
+             ti=ind(16)
+             ind(16)=WTURN6_LOW+(rand(0)*(WTURN6_HI-WTURN6_LOW))
+            case (17)
+             ti=ind(17)
+             ind(17)=WVDWPP_LOW+(rand(0)*(WVDWPP_HI-WVDWPP_LOW))
+            case (18)
+             ti=ind(18)
+             ind(18)=WHPB_LOW+(rand(0)*(WHPB_HI-WHPB_LOW))
+            case (19)
+             ti=ind(19)
+             ind(19)=WSCCOR_LOW+(rand(0)*(WSCCOR_HI-WSCCOR_LOW))
+        end select
+         write(tmptext,'(I4,A13,I2,A7,F7.5,A5,F7.5)') id," at position "&
+     &,i," from: ",ti," to: ",ind(i)
+         logtext = "Mutation occured in individual "//tmptext
+         call write2log (logtext)
+ 
+        endif
+2300   end do
+      end subroutine 
+
+c ======================================================================
+c  FunkcjaCeluB function
+c ======================================================================
+c  Simple (dummy) scoring function
+c ----------------------------------------------------------------------
+
+      real*8 function FunkcjaCeluB(osobnik)
+       include 'TEST.inc'
+       real*8 :: osobnik(20)
+       integer*4 :: i
+       FunkcjaCeluB = 20 + -exp(-abs(WLONG-osobnik(1)))                 &
+     & - exp(-abs(WSCP-osobnik(2)))                                     &
+     & - exp(-abs(WELEC-osobnik(3)))                                    &
+     & - exp(-abs(WBOND-osobnik(4)))                                    &
+     & - exp(-abs(WANG-osobnik(5)))                                     &
+     & - exp(-abs(WSCLOC-osobnik(6)))                                   &
+     & - exp(-abs(WTOR-osobnik(7)))                                     &
+     & - exp(-abs(WTORD-osobnik(8)))                                    &
+     & - exp(-abs(WCORRH-osobnik(9)))                                   &
+     & - exp(-abs(WCORR4-osobnik(10)))                                  &
+     & - exp(-abs(WCORR5-osobnik(11)))                                  &
+     & - exp(-abs(WCORR6-osobnik(12)))                                  &
+     & - exp(-abs(WEL_LOC-osobnik(13)))                                 &
+     & - exp(-abs(WTURN3-osobnik(14)))                                  &
+     & - exp(-abs(WTURN4-osobnik(15)))                                  &
+     & - exp(-abs(WTURN6-osobnik(16)))                                  &
+     & - exp(-abs(WVDWPP-osobnik(17)))                                  &
+     & - exp(-abs(WHPB-osobnik(18)))                                    &
+     & - exp(-abs(WSCCOR-osobnik(19)))
+       return
+      end function
+
+c ======================================================================
+c  FunkcjaCeluB2 function
+c ======================================================================
+c  Simple (dummy) scoring function
+c ----------------------------------------------------------------------
+
+      real*8 function FunkcjaCeluB2(osobnik)
+       include 'TEST.inc'
+       real*8 :: osobnik(20)
+       integer*4 :: i
+       FunkcjaCeluB2 = 1 + 4*(WLONG-osobnik(1))**2                      &
+     & + 4*(WSCP-osobnik(2))**2                                         &
+     & + 4*(WELEC-osobnik(3))**2                                        &
+     & + 4*(WBOND-osobnik(4))**2                                        &
+     & + 4*(WANG-osobnik(5))**2                                         &
+     & + 4*(WSCLOC-osobnik(6))**2                                       &
+     & + 4*(WTOR-osobnik(7))**2                                         &
+     & + 4*(WTORD-osobnik(8))**2                                        &
+     & + 4*(WCORRH-osobnik(9))**2                                       &
+     & + 4*(WCORR4-osobnik(10))**2                                      &
+     & + 4*(WCORR5-osobnik(11))**2                                      &
+     & + 4*(WCORR6-osobnik(12))**2                                      &
+     & + 4*(WEL_LOC-osobnik(13))**2                                     &
+     & + 4*(WTURN3-osobnik(14))**2                                      &
+     & + 4*(WTURN4-osobnik(15))**2                                      &
+     & + 4*(WTURN6-osobnik(16))**2                                      &
+     & + 4*(WVDWPP-osobnik(17))**2                                      &
+     & + 4*(WHPB-osobnik(18))**2                                        &
+     & + 4*(WSCCOR-osobnik(19))**2
+       return
+      end function
+
+c ======================================================================
+c  Weights2str subroutine
+c ======================================================================
+c  Writes weights of individual(osobnik) to string (lista)
+c ----------------------------------------------------------------------
+
+      subroutine Weights2Str(osobnik,coff,lista)   
+      real*8, dimension(19) :: osobnik
+      real*8 :: coff
+      character(80) :: a
+      integer :: i
+      character(80) :: lista
+      dimension lista(5)
+c      Zerowanie tablicy
+      do i=1,5
+       lista(i)=''
+      enddo
+c
+      !write(*,*) coff
+      write(a,"(A6,F7.5,A6,F7.5,A7,F7.5,A7,F7.5,A6,F7.5,A)") "WLONG=",os&
+     &obnik(1)," WSCP=",osobnik(2)," WELEC=",osobnik(3)," WBOND=",osobni&
+     &k(4)," WANG=",osobnik(5),"            &"
+      lista(1)=a
+      write(a,"(A7,F7.5,A6,F7.5,A7,F7.5,A8,F7.5,A8,F7.5,A)") "WSCLOC=",o&
+     &sobnik(6)," WTOR=",osobnik(7)," WTORD=",osobnik(8)," WCORRH=",osob&
+     &nik(9),"WCORR5=",osobnik(11),"        &"
+      lista(2)=a       
+      write(a,"(A7,F7.5,A9,F7.5,A8,F7.5,A8,F7.5,A8,F7.5,A)") "WCORR6=",o&
+     &sobnik(12)," WEL_LOC=",osobnik(13)," WTURN3=",osobnik(14)," WTURN4&
+     &=",osobnik(15),"WTURN6=",osobnik(16),"    &"
+      lista(3)=a
+      write(a,"(A7,F7.5,A6,F7.5,A8,F7.5,A)") "WVDWPP=",osobnik(17)," WHP&
+     &B=",osobnik(18)," WSCCOR=",osobnik(19),"                          &
+     &           &"
+      lista(4)=a
+      write(a,"(A7,F7.5,A8,F7.5)") "CUTOFF=",coff," WCORR4=",osobnik(10)
+      lista(5)=a
+      
+      end subroutine
+
+c ======================================================================
+c  FunkcjaCeluR function
+c ======================================================================
+c  Real scoring function
+c ----------------------------------------------------------------------
+
+      real*8 function FunkcjaCeluR(zscore)
+       real*8 :: zscore
+       if (zscore.eq.0) then
+        FunkcjaCeluR = 0
+       else
+        FunkcjaCeluR = 1/zscore
+       endif
+       return
+      end function
+
+c ======================================================================
+c  ReadInput subroutine
+c ======================================================================
+
+      subroutine ReadInput(status)
+      include "io.inc"
+      include 'common.inc'
+      include 'GA.inc'
+      logical :: ex
+      integer :: stat
+      integer*4 :: status
+      character*100 :: wiersz,tmp
+      !character*500 :: wiersze = ''
+      inquire(FILE=inpfn,EXIST=ex) 
+      if (ex) then
+       status = 0
+       call write2log('')
+       call write2log('==[ Reading main input ]======================')
+       call write2log('')
+       open(inp,file=inpfn)
+       do
+         read(inp, '(A)', iostat=stat) wiersz
+         if (stat /= 0) exit
+          if ((wiersz(1:4).eq.'PDB=').or.(wiersz(1:4).eq.'pdb=')) then
+           npdb=1
+            tmp = wiersz(5:len_trim(wiersz))
+            do i=1,len_trim(tmp)
+             if (tmp(i:i).eq.' ') then
+             npdb=npdb+1
+             endif
+            end do
+            if (npdb.gt.maxnpdb) then
+             call write2log("Number of input PDB exceeds maxnpdb!")
+             status = 1
+             exit
+            endif
+            do i=1,npdb
+             if (index(trim(tmp),' ').gt.0) then
+              pdbfiles(i)=tmp(1:index(trim(tmp),' '))
+             else
+              pdbfiles(i)=tmp(1:len_trim(tmp))
+             endif
+            tmp=tmp(index(trim(tmp),' ')+1:len_trim(tmp))
+          end do
+         endif ! Koniec czytania "PDB="
+  
+         if ((wiersz(1:4).eq.'ALG=').or.(wiersz(1:4).eq.'alg=')) then
+          alg=wiersz(5:len_trim(wiersz))
+          select case(alg)
+           case('simple')
+            call write2log ("Using 'simple' algorithm")
+           case('better')
+            call write2log ("Using 'better' algorithm")
+           case('betterv2')
+            call write2log ("Using 'betterv2' algorithm")
+           case('csa')
+            call write2log ("Using 'CSA' algorithm")
+           case('cluster')
+            call write2log ("Using 'Clustering CSA' algorithm")
+           case default
+            alg="csa"
+            call write2log ("Unknown algorithm. Using 'csa' as default")
+          end select
+         endif ! Koniec czytania "ALG="
+
+         select case (wiersz(1:12))
+          case('GENERATIONS=','generations=')
+           tmp = wiersz(13:len_trim(wiersz))
+           read(tmp,'(I)') maxgen 
+         end select ! Koniec czytania "GENERATIONS="
+
+c CICUTOFF=
+         select case(wiersz(1:9))
+          case('CICUTOFF=','cicutoff=')
+          tmp = wiersz(10:len_trim(wiersz))
+          read(tmp(1:len_trim(tmp)),'(F7.5)') cicutoff
+          call write2log("Initial CSA cutoff is set to "//tmp)
+         end select
+
+c POPULATION= 
+         select case(wiersz(1:11))
+          case('POPULATION=','population=')
+           tmp = wiersz(12:len_trim(wiersz))
+           read(tmp,'(I)') banksize
+           call write2log("Bank size is set to "//tmp)
+         end select
+
+c WHAMTEMPLATE
+         select case(wiersz(1:13))
+          case('WHAMTEMPLATE=','whamtemplate=')
+           tmp = wiersz(14:len_trim(wiersz))
+           ntwham=1
+           do i=1,len_trim(tmp)
+            if (tmp(i:i).eq.' ') then
+             ntwham=ntwham+1
+            endif
+           end do
+           if (ntwham.gt.maxnpdb) then
+            call write2log("Number of WHAM templates exceeds maxnpdb!")
+             status = 1
+             exit
+           endif
+           do i=1,ntwham
+            if (index(trim(tmp),' ').gt.0) then
+              whamtemplate(i)=tmp(1:index(trim(tmp),' '))
+            else
+              whamtemplate(i)=tmp(1:len_trim(tmp))
+            endif
+              tmp=tmp(index(trim(tmp),' ')+1:len_trim(tmp))
+            end do
+         end select
+
+c MREMDTEMPLATE=
+         select case(wiersz(1:14))
+          case('MREMDTEMPLATE=','mremdtemplate=')
+          tmp = wiersz(15:len_trim(wiersz))
+          ntmremd=1
+          do i=1,len_trim(tmp)
+           if (tmp(i:i).eq.' ') then
+           ntmremd=ntmremd+1
+           endif
+          end do
+          if (ntmremd.gt.maxnpdb) then
+            call write2log("Number of MREMD templates exceeds maxnpdb!")
+            status = 1
+            exit
+          endif
+          do i=1,ntmremd
+            if (index(trim(tmp),' ').gt.0) then
+             mremdtemplate(i)=tmp(1:index(trim(tmp),' '))
+            else
+             mremdtemplate(i)=tmp(1:len_trim(tmp))
+            endif
+            tmp=tmp(index(trim(tmp),' ')+1:len_trim(tmp))
+          end do
+         end select
+
+c MAXMIN= 
+         select case(wiersz(1:7))
+          case('MAXMIN=','maxmin=')
+          tmp = wiersz(8:len_trim(wiersz))
+          read(tmp,'(I)') maxminstep
+          if (maxminstep.gt.0) then
+           call write2log("ZSCORE weights minimalization set to "//tmp)
+           do_optima=.true.
+          else
+           call write2log("ZSCORE weights minimalization disabled")
+           do_optima=.false.
+          endif
+         end select
+
+c SCRIPTS=
+         select case(wiersz(1:8))
+          case('SCRIPTS=','scripts=')
+          nscripts=1
+          tmp = wiersz(9:len_trim(wiersz))
+          do i=1,len_trim(tmp)
+           if (tmp(i:i).eq.' ') then
+            nscripts=nscripts+1
+           endif
+          end do
+          if (nscripts.gt.maxscripts) then
+           call write2log("Number of scripts exceeds maxscripts!")
+           status = 1
+           exit
+          endif
+          do i=1,nscripts
+           if (index(trim(tmp),' ').gt.0) then
+            scripts(i)=tmp(1:index(trim(tmp),' '))
+           else
+            scripts(i)=tmp(1:len_trim(tmp))
+           endif
+           call write2log("Script will be used: "//scripts(i)) 
+           tmp=tmp(index(trim(tmp),' ')+1:len_trim(tmp))
+          end do
+         end select ! Koniec czytania "scripts="
+        end do
+
+        close(inp)
+
+c write additional info to log
+        write(tmp,'(F8.5)') MUTRATIO
+        call write2log("Mutation ratio is set to "//tmp)
+        write(tmp,'(I2)') BANK_MULTIPLIER
+        call write2log("Bank multiplier is set to "//tmp)
+        write(tmp,'(I5)') BANK_MULTIPLIER*banksize
+        tmp=adjustl(tmp)
+        call write2log("Trail population size will be "//trim(tmp)//" in&
+     &dividuals")
+      else
+        call write2log("Input file unresga.inp does not exist!!")
+        write(*,*) "Input file unresga.inp does not exist!!"
+        status = 1
+      endif
+
+c Checking set parameters after reading input
+
+c PDB= ?
+      if (npdb.eq.0) then
+        call write2log("Can't find 'PDB=' entry in input file")
+        status = 1
+      else
+       do i=1,npdb
+        inquire(FILE=trim(pdbfiles(i)),EXIST=ex)
+        if (.not.ex) then
+         call write2log("Can't find file "//trim(pdbfiles(i)))
+         status = 1
+        endif
+       enddo
+      endif
+
+c GENERATIONS= ?
+      if (maxgen.eq.0) then
+       call write2log("Couldn't find GENERATIONS= entry in input file")
+       status = 1 
+      endif
+
+c POPULATION= ?
+      if (banksize.eq.0) then
+       call write2log("Can't find POPULATION= entry in input file")
+       status=1
+      elseif(mod(banksize,2).eq.1) then
+       call write2log("POPULATION has to be a even number.")
+       status=1
+      endif
+
+c WHAMTEMPLATE= ?
+      if (ntwham.ne.npdb) then
+       call write2log("Number of WHAM templates and PDB files is not equ&
+     &al!")
+       status=1
+      endif
+
+c MREMDTEMPLATE= ?
+      if (ntmremd.ne.npdb) then
+       call write2log("Number of MREMD templates and PDB files is not eq&
+     &ual")
+       status=1
+      endif
+
+c SCRIPTS= ?
+      if (nscripts.gt.0) then
+       do i=1,nscripts
+        inquire(FILE=trim(scripts(i)),EXIST=ex)
+        if (.not.ex) then
+         call write2log("Can't find file "//trim(scripts(i)))
+         status = 1
+        endif
+       enddo
+      endif
+
+
+      end subroutine ReadInput
+
+
+c ======================================================================
+c  CreateInputs subroutine
+c ======================================================================
+c  Creates input files for MREMD, WHAM and ZSCORE. 
+c ----------------------------------------------------------------------
+
+      subroutine CreateInputs(rozmiar,pop)
+       include 'io.inc'
+       include 'GA.inc'
+       include 'common.inc'
+       character(80),dimension(5) :: wagi
+       integer*4 :: rozmiar,i,j,k
+       real*8 :: pop
+       dimension pop(rozmiar,21)
+       !character*50 :: pdbfiles(maxnpdb)
+       character*50 :: command,tmptext, prefix
+       character*256 :: line,plik
+       integer :: gdzie = 0
+       character(len=*), parameter :: FMT = "(F9.5,F8.5,F8.5,F8.5,F8.5,F&
+     &8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8&
+     &.5,F20.5)"
+       !write(tmptext,'(I10)') banksize
+       !call write2log(trim(tmptext))
+
+        do j=1,npdb
+         prefix=pdbfiles(j)(1:len_trim(pdbfiles(j))-4)
+c Create MREMD input
+         open(imremd, file = mremdtemplate(j))
+         plik=trim(prefix)//"_"//omremdfn
+         call write2log(trim("Creating MREMD input: "//plik))         
+         open(omremd, file = plik)
+3000     read(imremd, '(A)', end = 3010) line
+         gdzie = index (line, '{PREFIX}')
+         if (gdzie .ne. 0) then
+          line=trim(line(1:gdzie-1))//trim(prefix)//trim(line(gdzie+8:))
+          write(omremd,"(A)") trim(line)
+         elseif (index(line,'{POPSIZE}') .ne. 0) then
+          gdzie = index (line, '{POPSIZE}')
+          write(tmptext,'(I4)') rozmiar
+          line=trim(line(1:gdzie-1))//trim(adjustl(tmptext))//trim(line(
+     &gdzie+9:))
+          write(omremd,"(A)") trim(line)
+         elseif (index(line,'{WEIGHTS}') .ne. 0) then
+          gdzie = index (line, '{WEIGHTS}')
+          do i=1,rozmiar
+           call Weights2Str(pop(i,:),CUTOFF,wagi)
+           write(omremd,"(A)") wagi(1)
+           write(omremd,"(A)") wagi(2)
+           write(omremd,"(A)") wagi(3)
+           write(omremd,"(A)") wagi(4)
+           write(omremd,"(A)") wagi(5)
+          enddo
+         else
+          write(omremd,"(A)") trim(line)
+         endif
+
+         goto 3000
+3010     continue
+         close(imremd)
+         close(omremd)
+
+c Create WHAM input
+         open(iwham, file = whamtemplate(j))
+         plik=trim(prefix)//"_"//owhamfn
+         call write2log(trim("Creating WHAM input: "//plik))         
+         open(owham, file = plik)
+3015     read(iwham, '(A)', end = 3020) line
+         gdzie = index (line, '{PREFIX}')
+         if (gdzie .ne. 0) then
+          line=trim(line(1:gdzie-1))//trim(prefix)//trim(line(gdzie+8:))
+          write(owham,"(A)") trim(line)
+         elseif (index(line,'{POPSIZE}') .ne. 0) then
+          gdzie = index (line, '{POPSIZE}')
+          write(tmptext,'(I4)') rozmiar
+          line=trim(line(1:gdzie-1))//trim(adjustl(tmptext))//trim(line(&
+     &gdzie+9:))
+          write(owham,"(A)") trim(line)
+         elseif (index(line,'{WEIGHTS}') .ne. 0) then
+          gdzie = index (line, '{WEIGHTS}')
+          do i=1,rozmiar
+           call Weights2Str(pop(i,:),CUTOFF,wagi)
+           write(owham,"(A)") wagi(1)
+           write(owham,"(A)") wagi(2)
+           write(owham,"(A)") wagi(3)
+           write(owham,"(A)") wagi(4)
+           write(owham,"(A)") wagi(5)
+           write(owham,"(A)") ''
+          enddo
+         else
+           write(owham,"(A)") trim(line)
+         endif
+
+         goto 3015
+3020     continue
+         close(iwham)
+         close(owham)
+         enddo
+c Create ZSCORE input
+         open(izscore, file = izscorefn)
+         call write2log(trim("Creating ZSCORE input: "//ozscorefn))
+         open(ozscore, file = ozscorefn)
+3025     read(izscore, '(A)', end = 3030) line
+         gdzie = index (line, '{PREFIX')
+         if (gdzie .ne. 0) then
+          read(line(gdzie+7:gdzie+9),'(I2.2)') k 
+          prefix=pdbfiles(k)(1:len_trim(pdbfiles(k))-4)  
+          line=trim(line(1:gdzie-1))//trim(prefix)//trim(line(gdzie+10:)&
+     &)
+
+          write(ozscore,"(A)") trim(line)
+         elseif (index(line,'{PARAM') .ne. 0) then
+          gdzie=index(line,'{PARAM')
+          read(line(gdzie+6:gdzie+8),'(I2.2)') k 
+          prefix=pdbfiles(k)(1:len_trim(pdbfiles(k))-4)
+          do i=1,rozmiar
+           write(tmptext,'(I3.3)') i
+           line=trim(line(1:gdzie-1))//trim(prefix)//"_wham_par"//tmptex&
+     &t
+           write(ozscore,"(A)") trim(line)
+          enddo
+         elseif (index(line,'{POPSIZE}') .ne. 0) then
+          gdzie = index (line, '{POPSIZE}')
+          write(tmptext,'(I4)') rozmiar
+          line=trim(line(1:gdzie-1))//trim(adjustl(tmptext))//trim(line(&
+     &gdzie+9:))
+          write(ozscore,"(A)") trim(line)
+         elseif (index(line,'{WEIGHTS}') .ne. 0) then
+          gdzie = index (line, '{WEIGHTS}')
+          do i=1,rozmiar
+           call Weights2Str(pop(i,:),CUTOFF,wagi)
+           write(ozscore,"(A)") wagi(1)
+           write(ozscore,"(A)") wagi(2)
+           write(ozscore,"(A)") wagi(3)
+           write(ozscore,"(A)") wagi(4)
+           write(ozscore,"(A)") trim(wagi(5))
+           write(ozscore,"(A)") ''
+          enddo
+         elseif (index(line,'{MAXMIN}') .ne. 0) then
+          gdzie = index (line, '{MAXMIN}')
+          write(tmptext,'(I4)') maxminstep
+          line=trim(line(1:gdzie-1))//trim(adjustl(tmptext))//trim(line(&
+     &gdzie+9:))
+          write(ozscore,"(A)") trim(line)
+         else
+          write(ozscore,"(A)") trim(line)
+         endif
+
+         goto 3025
+3030     continue
+         close(izscore)
+         close(ozscore)
+
+c Copy scripts
+         call write2log('Copying scripts is disabled.')
+c       do i=1,nscripts
+c        ! Open output file
+c        plik=trim(prefix)//"/"//trim(scripts(i))
+c        open(oscript, file = plik)
+c         ! Open input file
+c        plik=trim(scripts(i))
+c        open(iscript, file = plik)
+c          ! rewrite from input to output
+c3030    read(iscript, '(A)', end = 3035) line
+c        write(oscript,'(A)') trim(line)
+c        goto 3030
+c3035    continue
+c        close(oscript)
+c        close(iscript)
+c       enddo
+c        enddo
+
+c ==========================================
+c  Dump weights
+c ==========================================
+
+       
+c       write(ow,'(I4)') generation
+c       write(ow,'(200A)') "# WLONG   WSCP    WELEC   WBOND    WANG   WSC&
+c     &LOC  WTOR    WTORD   WCORRH  WCORR4  WCORR5  WCORR6  WEL_LOC WTURN&
+c     &3  WTURN4  WTURN6  WVDWPP  WHPB    WSCCOR"
+c      do I=1,rozmiar
+c         write(ow,FMT) pop(i,1),pop(i,2),pop(i,3),pop(i,4), pop(i,5),pop&
+c     &(i,6),pop(i,7),pop(i,8),pop(i,9),pop(i,10),pop(i,11),pop(i,12),pop&
+c     &(i,13),pop(i,14),pop(i,15),pop(i,16),pop(i,17),pop(i,18),pop(i,19)
+c        enddo
+c       close(ow)
+
+c ==========================================
+c  Testcode before WHAM+ZSCORE integration
+c ==========================================
+c
+c      plik=trim(prefix)//"/"//trim(opopsumfn)
+c      !print *,trim(plik)
+c      open(opopsum, file = plik)
+c      write(opopsum,'(200A)') "# WLONG   WSCP    WELEC   WBOND   WANG 
+c    &   WSCLOC  WTOR    WTORD   WCORRH  WCORR4  WCORR5  WCORR6  WEL_LOC&
+c     & WTURN3  WTURN4  WTURN6  WVDWPP  WHPB    WSCCOR  SCORE"
+c      do I=1,rozmiar
+c       write(opopsum,FMT) pop(i,1),pop(i,2),pop(i,3),pop(i,4), pop(i,5)&
+c     &,pop(i,6),pop(i,7),pop(i,8),pop(i,9),pop(i,10),pop(i,11),pop(i,12)&
+c     &,pop(i,13),pop(i,14),pop(i,15),pop(i,16),pop(i,17),pop(i,18),pop(i&
+c     &,19),pop(i,20)
+c      end do
+c      close(opopsum)
+c ==========================================
+
+
+c        command="mkdir zscore"
+c      call system(command)
+
+       
+      end subroutine CreateInputs
+
+  
+c ======================================================================
+c  ZnajdzPodobnego function
+c ======================================================================
+c  Finds the most similar individual to osobnik in population(populacja)
+c  and returns his position in the population
+c ----------------------------------------------------------------------
+
+      integer*4 function ZnajdzPodobnego(rozmiar,populacja,osobnik,csacu&
+     &toff)
+      integer*4 :: rozmiar,pozycja
+      real*8 :: delta,mindelta,csacutoff
+      character*30 :: tmp
+      real*8, dimension(rozmiar,21) :: populacja
+      real*8, dimension(21) :: osobnik 
+
+      mindelta = csacutoff
+c mindelta = 10000.0
+      pozycja = 0
+
+      do i=1,rozmiar
+        delta = 0.0
+        do j=1,19
+          delta=delta+(populacja(i,j)-osobnik(j))**2
+        enddo
+c        write(tmp,'(2F7.5 )') delta,csacutoff 
+c        call write2log("Delta is "//tmp)
+        
+        if (delta.lt.mindelta) then
+          mindelta=delta
+          pozycja=i
+          write(tmp,'(F7.5,X,I)') delta,pozycja
+          call write2log("Delta is "//tmp)
+        endif
+      end do
+
+      ZnajdzPodobnego = pozycja
+      end function
+  
+c ======================================================================
+c  WybierzOsobnika function
+c ======================================================================
+c  Selects individual from population using roulette method
+c ----------------------------------------------------------------------
+
+      integer*4 function WybierzOsobnika(rozmiar,populacja)
+      integer*4 :: osobnik, rozmiar 
+      real*8 :: los, partsum
+
+      real*8, dimension(rozmiar,21) :: populacja
+       
+      partsum = 0.0
+      osobnik = 0
+      los = rand(0)
+       do
+         osobnik = osobnik + 1
+         partsum = partsum + populacja(osobnik,21)
+         if ((osobnik.eq.rozmiar).or.(partsum.ge.los)) exit
+       end do
+      
+       WybierzOsobnika = osobnik
+       return
+      end function
+
+c ======================================================================
+c  Najlepszy function
+c ======================================================================
+c  Selects the individual with the best score from population
+c ----------------------------------------------------------------------
+
+      integer*4 function Najlepszy(rozmiar, maks, populacja)
+      integer*4 :: rozmiar
+      real*8 :: maks
+      real*8, dimension(rozmiar,21) :: populacja
+       Najlepszy = 0
+      do i=1,rozmiar
+       if (populacja(i,20).eq.maks) then
+        Najlepszy = i
+       endif
+      end do
+       return
+      end function
+
+c ======================================================================
+c  WriteState subroutine
+c ======================================================================
+c  Writes current state of calculations in case jobs have to be
+c  restartet
+c ----------------------------------------------------------------------
+
+      subroutine WriteState()
+       include 'GA.inc'
+       include 'io.inc'
+       include 'common.inc'
+
+       open(ostate,file=ostatefn)
+       write(ostate,'(I4)') generation
+       write(ostate,'(L2)') do_optima
+       write(ostate,'(L2)') do_ga
+       close(ostate)
+      end subroutine WriteState
+ 
+c ======================================================================
+c  ReadPopulation subroutine
+c ======================================================================
+c  Reads population from population.summary file
+c ----------------------------------------------------------------------
+
+      subroutine ReadPopulation(nind,pop)
+       integer*4 :: i,nind
+       real*8 :: pop
+       character*8 :: dummy
+       dimension pop(nind,21) 
+       include 'GA.inc'
+       include 'io.inc'
+       character(len=*), parameter :: FMT = "(F9.5,F8.5,F8.5,F8.5,F8.5,F&
+     &8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8&
+     &.5,F20.5)"
+       read(opopsum,'(A)') dummy
+       do i=1,nind
+       read(opopsum,FMT) pop(i,1),pop(i,2),pop(i,3),pop(i,4), pop(i,5),p&
+     &op(i,6),pop(i,7),pop(i,8),pop(i,9),pop(i,10),pop(i,11),pop(i,12),p&
+     &op(i,13),pop(i,14),pop(i,15),pop(i,16),pop(i,17),pop(i,18),pop(i,1&
+     &9),pop(i,20)
+       end do
+      end subroutine ReadPopulation
+
+c ======================================================================
+c  ReadOptimaW subroutine
+c ======================================================================
+c  Reads weights from zscore generated weights_opt.zscorepar_XXX files
+c  
+c  nind - number of individuals/files to read
+c  pop - array where weights are stored  
+c ----------------------------------------------------------------------
+
+      subroutine ReadOptimaW(nind,pop)
+       integer*4 :: i,nind,stat
+
+       real*8 :: pop
+       character*40 :: filename
+       character*200 :: tmptxt
+       dimension pop(nind,21)
+       logical :: err 
+       include 'GA.inc'
+       include 'io.inc'
+   
+c Cosmetic stuff for pretty log
+       call write2log("==[ Reading weights from zscore files ]=======")
+       call write2log("# WLONG    WSCP     WELEC    WBOND    WANG     WS&
+     &CLOC   WTOR     WTORD    WCORRH   WCORR4   WCORR5   WCORR6   WEL_L&
+     &OC  WTURN3   WTURN4   WTURN6   WVDWPP   WHPB     WSCCOR")
+
+c Actual weight read and error handling
+       do i=1,nind
+        err=.false.
+        write(tmptxt,'(I3.3)') i
+        filename = "weights_opt.zscorepar_"//trim(tmptxt)
+        open(izsoptw, file = filename)
+        read(izsoptw,"(A4,F7.5,A6,F7.5,A7,F7.5,A7,F7.5,A6,F7.5,A)",iosta&
+     &t=stat) tmptxt,pop(i,1),tmptxt,pop(i,2),tmptxt,pop(i,3),tmptxt,pop&
+     &(i,4),tmptxt,pop(i,5)
+        if (stat/=0) then
+         err=.true.
+         call write2log("-- ERROR while reading "//trim(filename)//"--")
+         do j=1,21 
+          pop(i,j)=0.0
+         enddo
+         goto 4000
+        endif
+        read(izsoptw,"(A7,F7.5,A6,F7.5,A7,F7.5,A8,F7.5,A8,F7.5,A)",iosta&
+     &t=stat) tmptxt,pop(i,6),tmptxt,pop(i,7),tmptxt,pop(i,8),tmptxt,pop&
+     &(i,9),tmptxt,pop(i,11)
+        if (stat/=0) then
+         err=.true.
+         call write2log("-- ERROR while reading "//trim(filename)//"--")
+         do j=1,21 
+          pop(i,j)=0.0
+         enddo
+         goto 4000
+        endif
+        read(izsoptw,"(A7,F7.5,A9,F7.5,A8,F7.5,A8,F7.5,A8,F7.5,A)",iosta&
+     &t=stat) tmptxt,pop(i,12),tmptxt,pop(i,13),tmptxt,pop(i,14),tmptxt,&
+     &pop(i,15),tmptxt,pop(i,16)
+         if (stat/=0) then
+         err=.true.
+         call write2log("-- ERROR while reading "//trim(filename)//"--")
+         do j=1,21 
+          pop(i,j)=0.0
+         enddo
+         goto 4000
+        endif
+        read(izsoptw,"(A7,F7.5,A8,F7.5,A6,F7.5,A)",iostat=stat) tmptxt, &
+     &pop(i,19),tmptxt,pop(i,17),tmptxt,pop(i,18),tmptxt
+         if (stat/=0) then
+         err=.true.
+         call write2log("-- ERROR while reading "//trim(filename)//"--")
+         do j=1,21 
+          pop(i,j)=0.0
+         enddo
+         goto 4000
+        endif
+        read(izsoptw,"(A22,F7.5)",iostat=stat) tmptxt, pop(i,10)
+        if (stat/=0) then
+        err=.true.
+        call write2log("-- ERROR while reading "//trim(filename)//"--")
+        do j=1,21 
+         pop(i,j)=0.0
+        enddo
+        endif
+
+        if (.not.err) then
+         write(tmptxt,'(19F9.5)') (pop(i,j),j=1,19)
+         call write2log(trim(tmptxt))
+        endif 
+
+4000    close(izsoptw)
+       end do
+      end subroutine ReadOptimaW
+
+
+c ======================================================================
+c  ReadZEnergy subroutine
+c ======================================================================
+c  Reads Energy from ZSCORE output files zscore_out_parXXX_GB000
+c ----------------------------------------------------------------------
+
+      subroutine ReadZEnergy(nind,pop)
+       integer*4 :: i,nind
+       integer*4 :: stat
+       real*8 :: pop
+       character*40 :: filename,tmptxt,tmptxt2
+       character*100 :: wiersz
+       dimension pop(nind,21) 
+       include 'io.inc'
+    
+       call write2log("==[ Reading Final Function Value from zscore ]===&
+     &====")
+       do i=1,nind
+        write(tmptxt,'(I3.3)') i
+        pop(i,20)=0
+        filename=trim(izenergyfn)//trim(tmptxt)//"_GB000"
+        open(izenergy, file = filename)
+        do
+         read(izenergy, '(A)', iostat=stat) wiersz
+         if (stat /= 0) exit
+         if (wiersz(1:22).eq.' Final function value:') then
+          tmptxt=trim(adjustl(wiersz(23:48)))
+          read(tmptxt,'(F16.5)') pop(i,20)
+          write(tmptxt2,'(E15.7)') pop(i,20) 
+          call write2log("Reading score from "//filename//" : "//tmptxt/&
+     &/" : "//tmptxt2)
+         endif
+        end do
+        if (pop(i,20).eq.0) then
+         call write2log("ERROR while reading FFV from "//filename)
+        endif 
+        close(izenergy)
+       end do
+
+      end subroutine ReadZEnergy
+
+c =======================================================================
+c  WritePopSum subroutine
+c =======================================================================
+c  Writes whole individuals (weights, score, ID, generation) to file 
+c  population.summary  This file can be used to plot evolution of the 
+c  weights and scores over time. 
+c -----------------------------------------------------------------------
+      subroutine WritePopSum()
+       logical :: jestplik = .false.
+       character*5 :: tmptext
+c       integer*4 :: nind
+c       real*8 :: bank 
+c       dimension bank(nind,21)
+       include 'io.inc'
+       include 'common.inc'
+       
+
+c      write(*,*)  banksize
+
+      write(tmptext,'(I3.3)') generation
+      inquire(file=opopsumfn, exist=jestplik) 
+      if (.not. jestplik) then
+       open(opopsum, file = opopsumfn)
+       write(opopsum, "(A189)") "# WLONG   WSCP    WELEC   WBOND   WANG &
+     &   WSCLOC  WTOR    WTORD   WCORRH  WCORR4  WCORR5  WCORR6  WEL_LOC&
+     & WTURN3  WTURN4  WTURN6  WVDWPP  WHPB    WSCCOR                SCO&
+     &RE    IND      GEN"
+       close(opopsum)
+      endif
+   
+      open(opopsum, file = opopsumfn, access = "append")
+c       call ReadPopulation(banksize,populacja)
+      write(opopsum, "(A189)") "# ==== Generation "//trim(tmptext)//" ==&
+     &==================================================================&
+     &==================================================================&
+     &================================="
+c       call write2log(banksize)
+       do i=1,banksize
+c      write(*,*) i 
+c        write(opopsum,"(F9.5,2F8.5)") populacja(i,1),populacja(i,2),popu&
+c     &lacja(i,3) 
+      write(opopsum,"(F9.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,&
+     &F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F8.5,F20.5,I8,I8)") bank(i&
+     &,1),bank(i,2),bank(i,3),bank(i,4),bank(i,5),bank(i,6),bank(i,7),ba&
+     &nk(i,8),bank(i,9),bank(i,10),bank(i,11),bank(i,12),bank(i,13),bank&
+     &(i,14),bank(i,15),bank(i,16),bank(i,17),bank(i,18),bank(i,19),bank&
+     &(i,20),i,iter
+       enddo
+      write(opopsum,*) ""
+      close(opopsum)
+
+      end subroutine WritePopSum
+
+c ======================================================================
+c  WriteBank subroutine
+c ======================================================================
+c  Writes CSA BANK to file 
+c ----------------------------------------------------------------------
+      subroutine WriteBank(b)
+       include 'io.inc'
+       include 'common.inc'
+       real*8,dimension(banksize,21) :: b  
+       character*250 :: tmptext
+       character*250 :: header   
+
+
+       header="#    WLONG      WSCP     WELEC     WBOND      WANG    WSC&
+     &LOC      WTOR     WTORD    WCORRH    WCORR4    WCORR5    WCORR6   &
+     &WEL_LOC    WTURN3    WTURN4    WTURN6    WVDWPP      WHPB    WSCCO&
+     &R            FFV   FITNESS" 
+ 
+       call write2log("Writing Bank to file "//iobankfn)
+       open(iobank, file = iobankfn)
+       write(iobank, "(A)") trim(adjustl(header))
+       
+       do i=1,banksize
+        write(iobank,'(19F10.5,E15.7,F10.5)') (b(i,j),j=1,21)
+        write(tmptext,'(19F10.5,E15.7,F10.5)') (b(i,j),j=1,21)
+        call write2log(trim(tmptext))  
+       enddo 
+       close(iobank)
+      end subroutine
+
+c ======================================================================
+c  ReadBank subroutine
+c ======================================================================
+c  Read CSA BANK from file
+c ----------------------------------------------------------------------
+      subroutine ReadBank(b)
+       include 'io.inc'
+       include 'common.inc'
+       real*8,dimension(banksize,21) :: b 
+       character*250 :: tmptext 
+
+       call write2log("Reading Bank from file "//iobankfn)  
+       open(iobank, file = iobankfn)
+c skip header
+       read(iobank,"(A)") tmptext 
+       do i=1,banksize
+        read(iobank,"(19F10.5,E15.7,F10.5)") (b(i,j),j=1,21)
+        write(tmptext,'(19F10.5,E15.7,F10.5)') (b(i,j),j=1,21)
+        call write2log(trim(tmptext))
+       enddo 
+       close(iobank)
+      end subroutine
+
+c ======================================================================
+c  CalcFitness subroutine
+c ======================================================================
+c  Calculates fitness of every individual in the bank
+c ----------------------------------------------------------------------
+      subroutine CalcFitness(b,fitn)
+       include 'common.inc'
+       real*8,dimension(banksize,21) :: b
+       real*8 :: fitn, sumfitn
+
+       fitn = 0.0
+       sumfitn = 0.0
+
+       do i=1,banksize
+        fitn=fitn+(1/b(i,20))
+        sumfitn=sumfitn+b(i,20)
+       end do
+       do i=1,banksize
+        b(i,21)=1/(b(i,20)*fitn)
+c        b(i,21)=b(i,20)/fitn
+       end do
+       fitn=sumfitn 
+      end subroutine
+
+c -----------------------------------------------------------------------
+
+

diff --git a/source/ga/GA.inc b/source/ga/GA.inc
new file mode 100644 (file)
index 0000000..21e22b7
--- /dev/null
+++ b/source/ga/GA.inc
@@ -0,0 +1,55 @@
+c ======================================================================
+c  Genetic Algorythm Constants
+c ======================================================================
+      real*8, parameter :: MUTRATIO = 0.05
+      real*8, parameter :: CUTOFF = 7.00000
+      integer, parameter :: BANK_MULTIPLIER = 2
+      integer, parameter :: IGNORE_WEIGHT(19) = (/1,0,0,1,0,0,0,0,0,1,1,&
+     &1,0,0,0,1,0,1,0/)
+
+c  -- UNRES weight-ranges values --
+      real*8, parameter :: WLONG_HI   = 1.00000        ! 1
+      real*8, parameter :: WLONG_LOW  = 1.00000 
+      real*8, parameter :: WSCP_HI    = 1.80000        ! 2
+      real*8, parameter :: WSCP_LOW   = 1.00000
+      real*8, parameter :: WELEC_HI   = 1.20000        ! 3
+      real*8, parameter :: WELEC_LOW  = 0.60000
+      real*8, parameter :: WBOND_HI   = 1.00000        ! 4
+      real*8, parameter :: WBOND_LOW  = 1.00000
+      real*8, parameter :: WANG_HI    = 2.00000        ! 5
+      real*8, parameter :: WANG_LOW   = 0.60000
+      real*8, parameter :: WSCLOC_HI  = 2.00000        ! 6
+      real*8, parameter :: WSCLOC_LOW = 0.10000
+      real*8, parameter :: WTOR_HI    = 2.00000        ! 7
+      real*8, parameter :: WTOR_LOW   = 1.00000
+      real*8, parameter :: WTORD_HI   = 1.80000        ! 8
+      real*8, parameter :: WTORD_LOW  = 1.00000
+      real*8, parameter :: WCORRH_HI  = 0.30000        ! 9
+      real*8, parameter :: WCORRH_LOW = 0.00000
+      real*8, parameter :: WCORR4_HI  = 0.00000        ! 10
+      real*8, parameter :: WCORR4_LOW = 0.00000
+      real*8, parameter :: WCORR5_HI  = 0.00000        ! 11
+      real*8, parameter :: WCORR5_LOW = 0.00000
+      real*8, parameter :: WCORR6_HI  = 0.00000        ! 12
+      real*8, parameter :: WCORR6_LOW = 0.00000
+      real*8, parameter :: WEL_LOC_HI = 0.40000        ! 13
+      real*8, parameter :: WEL_LOC_LOW= 0.10000
+      real*8, parameter :: WTURN3_HI  = 2.00000        ! 14
+      real*8, parameter :: WTURN3_LOW = 1.00000
+      real*8, parameter :: WTURN4_HI  = 1.40000        ! 15
+      real*8, parameter :: WTURN4_LOW = 0.40000
+      real*8, parameter :: WTURN6_HI  = 0.00000        ! 16
+      real*8, parameter :: WTURN6_LOW = 0.00000
+      real*8, parameter :: WVDWPP_HI  = 1.20000        ! 17
+      real*8, parameter :: WVDWPP_LOW = 0.60000
+      real*8, parameter :: WHPB_HI    = 0.00000        ! 18
+      real*8, parameter :: WHPB_LOW   = 0.00000
+      real*8, parameter :: WSCCOR_HI  = 1.00000        ! 19
+      real*8, parameter :: WSCCOR_LOW = 0.00000
+
+C -- UNRES weight values names --
+      character*7, parameter :: WNAME(19) = (/ 'WLONG','WSCP','WELEC',  &
+     &'WBOND','WANG','WSCLOC','WTOR','WTORD','WCORRH','WCORR4','WCORR5',&
+     &'WCORR6','WEL_LOC','WTURN3','WTURN4','WTURN6', 'WVDWPP','WHPB',   &
+     &'WSCCOR' /) 
+    

diff --git a/source/ga/Makefile b/source/ga/Makefile
new file mode 100644 (file)
index 0000000..13399f6
--- /dev/null
+++ b/source/ga/Makefile
@@ -0,0 +1,33 @@
+
+CC             := ifort
+CFLAGS         := 
+
+BUILD_DIR      := build        
+
+CLUSTER                := matrix
+
+# CLUSTER options:  matrix, piasek, galera
+
+.PHONY: all checkdirs clean
+
+all: checkdirs checktpl build/unresga
+
+build/unresga:GA.f
+       $(CC) $(CFLAGS) GA.f -o $@
+
+
+checkdirs: $(BUILD_DIR)
+
+
+$(BUILD_DIR):
+       @mkdir -p $@
+
+
+checktpl:
+       @echo "";echo "==] building $(CLUSTER) version [=="
+       @echo ""
+       @cp input-templates/*.pdb $(BUILD_DIR)
+       @cp input-templates/$(CLUSTER)/* $(BUILD_DIR)
+
+clean:
+       @rm -rf $(BUILD_DIR)

diff --git a/source/ga/TEST.inc b/source/ga/TEST.inc
new file mode 100644 (file)
index 0000000..eb97ef6
--- /dev/null
+++ b/source/ga/TEST.inc
@@ -0,0 +1,19 @@
+      real, parameter :: WLONG   = 1.00000
+      real, parameter :: WSCP    = 1.76300
+      real, parameter :: WELEC   = 0.62354
+      real, parameter :: WBOND   = 0.72319
+      real, parameter :: WANG    = 0.43201
+      real, parameter :: WSCLOC  = 0.32467
+      real, parameter :: WTOR    = 0.15243
+      real, parameter :: WTORD   = 0.66666
+      real, parameter :: WCORRH  = 0.43434
+      real, parameter :: WCORR4  = 0.00000
+      real, parameter :: WCORR5  = 0.00000
+      real, parameter :: WCORR6  = 0.00000
+      real, parameter :: WEL_LOC = 0.12345
+      real, parameter :: WTURN3  = 1.35791
+      real, parameter :: WTURN4  = 0.36361
+      real, parameter :: WTURN6  = 0.52192
+      real, parameter :: WVDWPP  = 0.73452
+      real, parameter :: WHPB    = 0.45454
+      real, parameter :: WSCCOR  = 0.00000

diff --git a/source/ga/TODO b/source/ga/TODO
new file mode 100644 (file)
index 0000000..38b9fad
--- /dev/null
+++ b/source/ga/TODO
@@ -0,0 +1,11 @@
+=====================================
+=        TODO
+=====================================
+
+
+
+- CreateInputs nie generuje pełnej populacji, a jedynie ucina do rozmiaru banku - do poprawy
+
+- definicje szablonu dla ZSCORE w głównym inpucie (w tej chwili jest w io.inc)
+
+- wprowadzić klasterowanie

diff --git a/source/ga/cluster.inc b/source/ga/cluster.inc
new file mode 100644 (file)
index 0000000..9a78d67
--- /dev/null
+++ b/source/ga/cluster.inc
@@ -0,0 +1,389 @@
+      SUBROUTINE KMNS(A, M, N, C, K, IC1, IC2, NC, AN1, AN2, NCP, D,    &
+     &ITRAN, LIVE, ITER, WSS, IFAULT)
+C
+C     ALGORITHM AS 136  APPL. STATIST. (1979) VOL.28, NO.1
+C
+C     Divide M points in N-dimensional space into K clusters so that
+C     the within cluster sum of squares is minimized.
+C
+      integer*4 :: I,IJ,IL,J,K,L,M,N,AA
+      integer*4 :: INDX,ITER,IFAULT,DA,DC
+      integer*4 :: IC1(M), IC2(M), NC(K), NCP(K), ITRAN(K), LIVE(K)
+c      real*8    :: A, C, D, AN1, AN2(K),WSS(K), DT(2)
+      real*8    :: BIG, ZERO, ONE, DB
+
+      real*8, dimension(M,N)   :: A
+      real*8, dimension(K,N)   :: C
+      real*8, dimension(M)     :: D
+      real*8, dimension(K)     :: AN1
+      real*8, dimension(K)     :: AN2
+      real*8, dimension(K)     :: WSS
+      real*8, dimension(2)     :: DT
+
+C
+C     Define BIG to be a very large positive number
+C
+      DATA BIG /1.E30/, ZERO /0.0/, ONE /1.0/
+C
+      IFAULT = 3
+      IF (K .LE. 1 .OR. K .GE. M) RETURN
+C
+C     For each point I, find its two closest centres, IC1(I) and
+C     IC2(I).     Assign it to IC1(I).
+C
+      DO 50 I = 1, M
+       IC1(I) = 1
+       IC2(I) = 2
+       DO 10 IL = 1, 2
+         DT(IL) = ZERO
+         DO 10 J = 1, N
+           DA = A(I,J) - C(IL,J)
+           DT(IL) = DT(IL) + DA*DA
+   10   CONTINUE
+       IF (DT(1) .GT. DT(2)) THEN
+         IC1(I) = 2
+         IC2(I) = 1
+         TEMP = DT(1)
+         DT(1) = DT(2)
+         DT(2) = TEMP
+       END IF
+       DO 50 L = 3, K
+         DB = ZERO
+         DO 30 J = 1, N
+           DC = A(I,J) - C(L,J)
+           DB = DB + DC*DC
+           IF (DB .GE. DT(2)) GO TO 50
+   30     CONTINUE
+         IF (DB .LT. DT(1)) GO TO 40
+         DT(2) = DB
+         IC2(I) = L
+         GO TO 50
+   40     DT(2) = DT(1)
+         IC2(I) = IC1(I)
+         DT(1) = DB
+         IC1(I) = L
+   50 CONTINUE
+C
+C     Update cluster centres to be the average of points contained
+C     within them.
+C
+      DO 70 L = 1, K
+       NC(L) = 0
+       DO 60 J = 1, N
+   60   C(L,J) = ZERO
+   70 CONTINUE
+      DO 90 I = 1, M
+       L = IC1(I)
+       NC(L) = NC(L) + 1
+       DO 80 J = 1, N
+   80   C(L,J) = C(L,J) + A(I,J)
+   90 CONTINUE
+C
+C     Check to see if there is any empty cluster at this stage
+C
+      DO 120 L = 1, K
+       IF (NC(L) .EQ. 0) THEN
+         IFAULT = 1
+         RETURN
+       END IF
+       AA = NC(L)
+       DO 110 J = 1, N
+  110   C(L,J) = C(L,J) / AA
+C
+C     Initialize AN1, AN2, ITRAN & NCP
+C     AN1(L) = NC(L) / (NC(L) - 1)
+C     AN2(L) = NC(L) / (NC(L) + 1)
+C     ITRAN(L) = 1 if cluster L is updated in the quick-transfer stage,
+C              = 0 otherwise
+C     In the optimal-transfer stage, NCP(L) stores the step at which
+C     cluster L is last updated.
+C     In the quick-transfer stage, NCP(L) stores the step at which
+C     cluster L is last updated plus M.
+C
+       AN2(L) = AA / (AA + ONE)
+       AN1(L) = BIG
+       IF (AA .GT. ONE) AN1(L) = AA / (AA - ONE)
+       ITRAN(L) = 1
+       NCP(L) = -1
+  120 CONTINUE
+      INDX = 0
+      DO 140 IJ = 1, ITER
+C
+C     In this stage, there is only one pass through the data.   Each
+C     point is re-allocated, if necessary, to the cluster that will
+C     induce the maximum reduction in within-cluster sum of squares.
+C
+       CALL OPTRA(A, M, N, C, K, IC1, IC2, NC, AN1, AN2, NCP, D,
+     *        ITRAN, LIVE, INDX)
+C
+C     Stop if no transfer took place in the last M optimal transfer
+C     steps.
+C
+       IF (INDX .EQ. M) GO TO 150
+C
+C     Each point is tested in turn to see if it should be re-allocated
+C     to the cluster to which it is most likely to be transferred,
+C     IC2(I), from its present cluster, IC1(I).   Loop through the
+C     data until no further change is to take place.
+C
+       CALL QTRAN(A, M, N, C, K, IC1, IC2, NC, AN1, AN2, NCP, D,
+     *       ITRAN, INDX)
+C
+C     If there are only two clusters, there is no need to re-enter the
+C     optimal transfer stage.
+C
+       IF (K .EQ. 2) GO TO 150
+C
+C     NCP has to be set to 0 before entering OPTRA.
+C
+       DO 130 L = 1, K
+  130   NCP(L) = 0
+  140 CONTINUE
+C
+C     Since the specified number of iterations has been exceeded, set
+C     IFAULT = 2.   This may indicate unforeseen looping.
+C
+      IFAULT = 2
+C
+C     Compute within-cluster sum of squares for each cluster.
+C
+  150 DO 160 L = 1, K
+       WSS(L) = ZERO
+       DO 160 J = 1, N
+         C(L,J) = ZERO
+  160 CONTINUE
+      DO 170 I = 1, M
+       II = IC1(I)
+       DO 170 J = 1, N
+         C(II,J) = C(II,J) + A(I,J)
+  170 CONTINUE
+      DO 190 J = 1, N
+       DO 180 L = 1, K
+  180   C(L,J) = C(L,J) / FLOAT(NC(L))
+       DO 190 I = 1, M
+         II = IC1(I)
+         DA = A(I,J) - C(II,J)
+         WSS(II) = WSS(II) + DA*DA
+  190 CONTINUE
+C
+      RETURN
+      END
+C
+C
+      SUBROUTINE OPTRA(A, M, N, C, K, IC1, IC2, NC, AN1, AN2, NCP, D,
+     *      ITRAN, LIVE, INDX)
+C
+C     ALGORITHM AS 136.1  APPL. STATIST. (1979) VOL.28, NO.1
+C
+C     This is the optimal transfer stage.
+C
+C     Each point is re-allocated, if necessary, to the cluster that
+C     will induce a maximum reduction in the within-cluster sum of
+C     squares.
+C
+      INTEGER IC1(M), IC2(M), NC(K), NCP(K), ITRAN(K), LIVE(K)
+      REAL    A(M,N), D(M), C(K,N), AN1(K), AN2(K), ZERO, ONE
+C
+C     Define BIG to be a very large positive number.
+C
+      DATA BIG /1.0E30/, ZERO /0.0/, ONE/1.0/
+C
+C     If cluster L is updated in the last quick-transfer stage, it
+C     belongs to the live set throughout this stage.   Otherwise, at
+C     each step, it is not in the live set if it has not been updated
+C     in the last M optimal transfer steps.
+C
+      DO 10 L = 1, K
+       IF (ITRAN(L) .EQ. 1) LIVE(L) = M + 1
+   10 CONTINUE
+      DO 100 I = 1, M
+       INDX = INDX + 1
+       L1 = IC1(I)
+       L2 = IC2(I)
+       LL = L2
+C
+C     If point I is the only member of cluster L1, no transfer.
+C
+       IF (NC(L1) .EQ. 1) GO TO 90
+C
+C     If L1 has not yet been updated in this stage, no need to
+C     re-compute D(I).
+C
+       IF (NCP(L1) .EQ. 0) GO TO 30
+       DE = ZERO
+       DO 20 J = 1, N
+         DF = A(I,J) - C(L1,J)
+         DE = DE + DF*DF
+   20   CONTINUE
+       D(I) = DE * AN1(L1)
+C
+C     Find the cluster with minimum R2.
+C
+   30   DA = ZERO
+       DO 40 J = 1, N
+         DB = A(I,J) - C(L2,J)
+         DA = DA + DB*DB
+   40   CONTINUE
+       R2 = DA * AN2(L2)
+       DO 60 L = 1, K
+C
+C     If I >= LIVE(L1), then L1 is not in the live set.   If this is
+C     true, we only need to consider clusters that are in the live set
+C     for possible transfer of point I.   Otherwise, we need to consider
+C     all possible clusters.
+C
+         IF (I .GE. LIVE(L1) .AND. I .GE. LIVE(L) .OR. L .EQ. L1 .OR.
+     *        L .EQ. LL) GO TO 60
+         RR = R2 / AN2(L)
+         DC = ZERO
+         DO 50 J = 1, N
+           DD = A(I,J) - C(L,J)
+           DC = DC + DD*DD
+           IF (DC .GE. RR) GO TO 60
+   50     CONTINUE
+         R2 = DC * AN2(L)
+         L2 = L
+   60     CONTINUE
+         IF (R2 .LT. D(I)) GO TO 70
+C
+C     If no transfer is necessary, L2 is the new IC2(I).
+C
+         IC2(I) = L2
+         GO TO 90
+C
+C     Update cluster centres, LIVE, NCP, AN1 & AN2 for clusters L1 and
+C     L2, and update IC1(I) & IC2(I).
+C
+   70     INDX = 0
+         LIVE(L1) = M + I
+         LIVE(L2) = M + I
+         NCP(L1) = I
+         NCP(L2) = I
+         AL1 = NC(L1)
+         ALW = AL1 - ONE
+         AL2 = NC(L2)
+         ALT = AL2 + ONE
+         DO 80 J = 1, N
+           C(L1,J) = (C(L1,J) * AL1 - A(I,J)) / ALW
+           C(L2,J) = (C(L2,J) * AL2 + A(I,J)) / ALT
+   80     CONTINUE
+         NC(L1) = NC(L1) - 1
+         NC(L2) = NC(L2) + 1
+         AN2(L1) = ALW / AL1
+         AN1(L1) = BIG
+         IF (ALW .GT. ONE) AN1(L1) = ALW / (ALW - ONE)
+         AN1(L2) = ALT / AL2
+         AN2(L2) = ALT / (ALT + ONE)
+         IC1(I) = L2
+         IC2(I) = L1
+   90   CONTINUE
+       IF (INDX .EQ. M) RETURN
+  100 CONTINUE
+      DO 110 L = 1, K
+C
+C     ITRAN(L) = 0 before entering QTRAN.   Also, LIVE(L) has to be
+C     decreased by M before re-entering OPTRA.
+C
+       ITRAN(L) = 0
+       LIVE(L) = LIVE(L) - M
+  110 CONTINUE
+C
+      RETURN
+      END
+C
+C
+      SUBROUTINE QTRAN(A, M, N, C, K, IC1, IC2, NC, AN1, AN2, NCP, D,
+     *    ITRAN, INDX)
+C
+C     ALGORITHM AS 136.2  APPL. STATIST. (1979) VOL.28, NO.1
+C
+C     This is the quick transfer stage.
+C     IC1(I) is the cluster which point I belongs to.
+C     IC2(I) is the cluster which point I is most likely to be
+C         transferred to.
+C     For each point I, IC1(I) & IC2(I) are switched, if necessary, to
+C     reduce within-cluster sum of squares.  The cluster centres are
+C     updated after each step.
+C
+      INTEGER IC1(M), IC2(M), NC(K), NCP(K), ITRAN(K)
+      REAL    A(M,N), D(M), C(K,N), AN1(K), AN2(K), ZERO, ONE
+C
+C     Define BIG to be a very large positive number
+C
+      DATA BIG /1.0E30/, ZERO /0.0/, ONE /1.0/
+C
+C     In the optimal transfer stage, NCP(L) indicates the step at which
+C     cluster L is last updated.   In the quick transfer stage, NCP(L)
+C     is equal to the step at which cluster L is last updated plus M.
+C
+      ICOUN = 0
+      ISTEP = 0
+   10 DO 70 I = 1, M
+       ICOUN = ICOUN + 1
+       ISTEP = ISTEP + 1
+       L1 = IC1(I)
+       L2 = IC2(I)
+C
+C     If point I is the only member of cluster L1, no transfer.
+C
+       IF (NC(L1) .EQ. 1) GO TO 60
+C
+C     If ISTEP > NCP(L1), no need to re-compute distance from point I to
+C     cluster L1.   Note that if cluster L1 is last updated exactly M
+C     steps ago, we still need to compute the distance from point I to
+C     cluster L1.
+C
+       IF (ISTEP .GT. NCP(L1)) GO TO 30
+       DA = ZERO
+       DO 20 J = 1, N
+         DB = A(I,J) - C(L1,J)
+         DA = DA + DB*DB
+   20   CONTINUE
+       D(I) = DA * AN1(L1)
+C
+C     If ISTEP >= both NCP(L1) & NCP(L2) there will be no transfer of
+C     point I at this step.
+C
+   30   IF (ISTEP .GE. NCP(L1) .AND. ISTEP .GE. NCP(L2)) GO TO 60
+       R2 = D(I) / AN2(L2)
+       DD = ZERO
+       DO 40 J = 1, N
+         DE = A(I,J) - C(L2,J)
+         DD = DD + DE*DE
+         IF (DD .GE. R2) GO TO 60
+   40   CONTINUE
+C
+C     Update cluster centres, NCP, NC, ITRAN, AN1 & AN2 for clusters
+C     L1 & L2.   Also update IC1(I) & IC2(I).   Note that if any
+C     updating occurs in this stage, INDX is set back to 0.
+C
+       ICOUN = 0
+       INDX = 0
+       ITRAN(L1) = 1
+       ITRAN(L2) = 1
+       NCP(L1) = ISTEP + M
+       NCP(L2) = ISTEP + M
+       AL1 = NC(L1)
+       ALW = AL1 - ONE
+       AL2 = NC(L2)
+       ALT = AL2 + ONE
+       DO 50 J = 1, N
+         C(L1,J) = (C(L1,J) * AL1 - A(I,J)) / ALW
+         C(L2,J) = (C(L2,J) * AL2 + A(I,J)) / ALT
+   50   CONTINUE
+       NC(L1) = NC(L1) - 1
+       NC(L2) = NC(L2) + 1
+       AN2(L1) = ALW / AL1
+       AN1(L1) = BIG
+       IF (ALW .GT. ONE) AN1(L1) = ALW / (ALW - ONE)
+       AN1(L2) = ALT / AL2
+       AN2(L2) = ALT / (ALT + ONE)
+       IC1(I) = L2
+       IC2(I) = L1
+C
+C     If no re-allocation took place in the last M steps, return.
+C
+   60   IF (ICOUN .EQ. M) RETURN
+   70 CONTINUE
+      GO TO 10
+      END

diff --git a/source/ga/common.inc b/source/ga/common.inc
new file mode 100644 (file)
index 0000000..11f004a
--- /dev/null
+++ b/source/ga/common.inc
@@ -0,0 +1,29 @@
+      integer*4 :: timeArray(4)              ! used for random seed
+      integer*4 :: npdb = 0                  ! number of pdb files
+      integer*4 :: ntwham = 0                ! number of WHAM template files
+      integer*4 :: ntmremd = 0               ! number of MREMD template files
+      integer*4 :: nscripts = 0              ! number of shell scripts to copy
+      integer*4 :: maxgen = 0                ! maximum number of generations
+      integer*4 :: banksize = 0              ! size of bank 
+      integer*4 :: generation = 1            ! current generation
+      integer*4 :: maxminstep = 0            ! max minimalization to be done by zscore
+      integer*4,parameter :: maxnpdb = 10    ! hard limit for maximum number of proteins
+      integer*4,parameter :: maxscripts = 10 
+      real*8 :: cicutoff = 5.0               ! CSA initial cutoff 
+      real*8 :: csacutoff = 0.0              ! CSA cutoff
+      logical :: do_optima = .false.
+      logical :: do_ga = .false.
+      logical :: do_fs = .false.
+      character*32 :: pdbfiles(maxnpdb)
+      character*32 :: scripts(maxscripts)
+      character*32 :: whamtemplate(maxnpdb)
+      character*32 :: mremdtemplate(maxnpdb)
+      character*16 :: alg
+      
+      common /inputy/ npdb,nscripts,ntwham,ntmremd,maxgen,banksize,cicut&
+     &off,csacutoff,alg,pdbfiles,scripts,whamtemplate,mremdtemplate,gene&
+     &ration,maxminstep,do_optima, do_ga
+      character*7 :: version = "1.1.1"
+      character*50 :: info = "= Last modified by Lightnir 09/01/2012"
+      real*8,allocatable :: bank(:,:),populacja(:,:),temppopulacja(:,:)
+      integer*4, allocatable :: pairs(:)

diff --git a/source/ga/input-templates/1L2Y.pdb b/source/ga/input-templates/1L2Y.pdb
new file mode 100644 (file)
index 0000000..aa15c9c
--- /dev/null
+++ b/source/ga/input-templates/1L2Y.pdb
@@ -0,0 +1,11812 @@
+HEADER    DE NOVO PROTEIN                         25-FEB-02   1L2Y              
+TITLE     NMR STRUCTURE OF TRP-CAGE MINIPROTEIN CONSTRUCT TC5B                  
+COMPND    MOL_ID: 1;                                                            
+COMPND   2 MOLECULE: TC5B;                                                      
+COMPND   3 CHAIN: A;                                                            
+COMPND   4 ENGINEERED: YES                                                      
+SOURCE    MOL_ID: 1;                                                            
+SOURCE   2 SYNTHETIC: YES;                                                      
+SOURCE   3 OTHER_DETAILS: THE PROTEIN WAS SYNTHESIZED USING STANDARD            
+SOURCE   4 FMOC SOLID-PHASE SYNTHESIS METHODS ON AN APPLIED                     
+SOURCE   5 BIOSYSTEMS 433A PEPTIDE SYNTHESIZER.                                 
+KEYWDS    MINIPROTEIN, TWO-STATE FOLDING, TRP-CAGE, DE NOVO PROTEIN             
+EXPDTA    SOLUTION NMR                                                          
+NUMMDL    38                                                                    
+AUTHOR    J.W.NEIDIGH,R.M.FESINMEYER,N.H.ANDERSEN                               
+REVDAT   2   24-FEB-09 1L2Y    1       VERSN                                    
+REVDAT   1   29-MAY-02 1L2Y    0                                                
+JRNL        AUTH   J.W.NEIDIGH,R.M.FESINMEYER,N.H.ANDERSEN                      
+JRNL        TITL   DESIGNING A 20-RESIDUE PROTEIN.                              
+JRNL        REF    NAT.STRUCT.BIOL.              V.   9   425 2002              
+JRNL        REFN                   ISSN 1072-8368                               
+JRNL        PMID   11979279                                                     
+JRNL        DOI    10.1038/NSB798                                               
+REMARK   1                                                                      
+REMARK   2                                                                      
+REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
+REMARK   3                                                                      
+REMARK   3 REFINEMENT.                                                          
+REMARK   3   PROGRAM     : AMBER 6.0                                            
+REMARK   3   AUTHORS     : KOLLMAN                                              
+REMARK   3                                                                      
+REMARK   3  OTHER REFINEMENT REMARKS: 169 NOE DISTANCE CONSTRAINTS WERE         
+REMARK   3  EMPLOYED. CNS WAS EMPLOYED FOR S.A., FOLLOWED BY MINIMIZATION       
+REMARK   3  USING THE SANDER MODULE OF AMBER.                                   
+REMARK   4                                                                      
+REMARK   4 1L2Y COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
+REMARK 100                                                                      
+REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-FEB-02.                  
+REMARK 100 THE RCSB ID CODE IS RCSB015598.                                      
+REMARK 210                                                                      
+REMARK 210 EXPERIMENTAL DETAILS                                                 
+REMARK 210  EXPERIMENT TYPE                : NMR                                
+REMARK 210  TEMPERATURE           (KELVIN) : 282                                
+REMARK 210  PH                             : 7                                  
+REMARK 210  IONIC STRENGTH                 : NULL                               
+REMARK 210  PRESSURE                       : AMBIENT                            
+REMARK 210  SAMPLE CONTENTS                : 1.0-1.8 MM TC5B                    
+REMARK 210                                                                      
+REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY                           
+REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
+REMARK 210  SPECTROMETER MODEL             : DRX                                
+REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
+REMARK 210                                                                      
+REMARK 210  STRUCTURE DETERMINATION.                                            
+REMARK 210   SOFTWARE USED                 : XWINNMR 2.6, FELIX 95, CNS         
+REMARK 210                                   1.0, AMBER 6.0                     
+REMARK 210   METHOD USED                   : SIMULATED ANNEALING FROM           
+REMARK 210                                   RANDOM STRUCTURES FOLLOWED BY      
+REMARK 210                                   STEEPEST DESCENT MINIMIZATION      
+REMARK 210                                                                      
+REMARK 210 CONFORMERS, NUMBER CALCULATED   : 50                                 
+REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 38                                 
+REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH ACCEPTABLE         
+REMARK 210                                   COVALENT GEOMETRY, STRUCTURES      
+REMARK 210                                   WITH THE LEAST RESTRAINT           
+REMARK 210                                   VIOLATIONS                         
+REMARK 210                                                                      
+REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
+REMARK 210                                                                      
+REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D              
+REMARK 210  HOMONUCLEAR TECHNIQUES.                                             
+REMARK 215                                                                      
+REMARK 215 NMR STUDY                                                            
+REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
+REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
+REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
+REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
+REMARK 500                                                                      
+REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
+REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
+REMARK 500                                                                      
+REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
+REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
+REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
+REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
+REMARK 500                                                                      
+REMARK 500 STANDARD TABLE:                                                      
+REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
+REMARK 500                                                                      
+REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
+REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
+REMARK 500                                                                      
+REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
+REMARK 500  2 ARG A  16   NE  -  CZ  -  NH1 ANGL. DEV. =   3.6 DEGREES          
+REMARK 500 13 ARG A  16   NE  -  CZ  -  NH1 ANGL. DEV. =   4.7 DEGREES          
+REMARK 500                                                                      
+REMARK 500 REMARK: NULL                                                         
+REMARK 500                                                                      
+REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
+REMARK 500 SUBTOPIC: TORSION ANGLES                                             
+REMARK 500                                                                      
+REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
+REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
+REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
+REMARK 500                                                                      
+REMARK 500 STANDARD TABLE:                                                      
+REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
+REMARK 500                                                                      
+REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
+REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
+REMARK 500                                                                      
+REMARK 500  M RES CSSEQI        PSI       PHI                                   
+REMARK 500  5 LEU A   2      -34.83     72.95                                   
+REMARK 500  6 LEU A   2      -33.93     63.45                                   
+REMARK 500  9 LEU A   2      -18.34     57.13                                   
+REMARK 500 13 LEU A   2      -33.72     66.32                                   
+REMARK 500 18 LEU A   2       -3.11     60.50                                   
+REMARK 500 19 LEU A   2       -1.16     58.98                                   
+REMARK 500 20 LEU A   2      -32.96     68.39                                   
+REMARK 500 23 LEU A   2      -47.12     63.92                                   
+REMARK 500 28 LEU A   2       -2.46     61.26                                   
+REMARK 500 29 LEU A   2      -42.02     66.43                                   
+REMARK 500 34 PRO A  12       11.15    -66.86                                   
+REMARK 500                                                                      
+REMARK 500 REMARK: NULL                                                         
+REMARK 900                                                                      
+REMARK 900 RELATED ENTRIES                                                      
+REMARK 900 RELATED ID: 5292   RELATED DB: BMRB                                  
+REMARK 900 BMRB 5292 IS CHEMICAL SHIFTS FOR TC5B IN BUFFER AND BUFFER           
+REMARK 900 CONTAINING 30 VOL-% TFE.                                             
+REMARK 900 RELATED ID: 1JRJ   RELATED DB: PDB                                   
+REMARK 900 1JRJ IS AN ANALAGOUS C-TERMINAL STRUCTURE.                           
+DBREF  1L2Y A    1    20  PDB    1L2Y     1L2Y             1     20             
+SEQRES   1 A   20  ASN LEU TYR ILE GLN TRP LEU LYS ASP GLY GLY PRO SER          
+SEQRES   2 A   20  SER GLY ARG PRO PRO PRO SER                                  
+HELIX    1   1 ASN A    1  ASP A    9  1                                   9    
+HELIX    2   2 GLY A   10  GLY A   15  5                                   6    
+CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
+ORIGX1      1.000000  0.000000  0.000000        0.00000                         
+ORIGX2      0.000000  1.000000  0.000000        0.00000                         
+ORIGX3      0.000000  0.000000  1.000000        0.00000                         
+SCALE1      1.000000  0.000000  0.000000        0.00000                         
+SCALE2      0.000000  1.000000  0.000000        0.00000                         
+SCALE3      0.000000  0.000000  1.000000        0.00000                         
+MODEL        1                                                                  
+ATOM      1  N   ASN A   1      -8.901   4.127  -0.555  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.608   3.135  -1.618  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.117   2.964  -1.897  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.634   1.849  -1.758  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.437   3.396  -2.889  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.915   3.130  -2.611  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -11.269   2.700  -1.524  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -11.806   3.406  -3.543  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.330   3.957   0.261  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.740   5.068  -0.889  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.877   4.041  -0.293  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.930   2.162  -1.239  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.310   4.417  -3.193  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.108   2.719  -3.679  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.572   3.791  -4.444  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.757   3.183  -3.294  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.379   4.031  -2.228  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.923   4.002  -2.452  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.136   3.187  -1.404  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.391   2.274  -1.760  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.411   5.450  -2.619  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.795   6.450  -1.495  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.612   6.803  -0.599  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.351   7.748  -2.084  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.821   4.923  -2.394  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.750   3.494  -3.403  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.340   5.414  -2.672  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -4.813   5.817  -3.564  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.568   6.022  -0.858  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.207   5.905  -0.146  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.841   7.304  -1.183  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.929   7.477   0.197  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -4.607   8.209  -2.736  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -6.255   7.544  -2.657  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.592   8.445  -1.281  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.354   3.455  -0.111  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.690   2.738   0.981  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.102   1.256   1.074  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.291   0.409   1.442  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.964   3.472   2.302  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.824   3.339   3.290  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.746   2.217   4.138  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.820   4.326   3.332  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.657   2.076   5.018  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.725   4.185   4.205  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.639   3.053   5.043  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.433   2.881   5.861  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.934   4.245   0.120  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.615   2.768   0.796  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.117   4.513   2.091  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.886   3.096   2.750  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.513   1.456   4.101  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.877   5.200   2.695  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.576   1.221   5.669  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.033   4.952   4.233  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.187   3.395   5.567  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.342   0.925   0.689  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.857  -0.449   0.613  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.089  -1.221  -0.470  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.621  -2.334  -0.226  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.386  -0.466   0.343  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.197   0.540   1.197  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.959  -1.884   0.501  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.019   0.412   2.715  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.906   1.656   0.283  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.670  -0.941   1.568  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.554  -0.192  -0.697  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.900   1.531   0.912  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.257   0.424   0.964  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.509  -2.555  -0.232  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.759  -2.271   1.501  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.036  -1.871   0.332  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.306  -0.585   3.049  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -6.983   0.606   2.995  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.656   1.144   3.213  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.907  -0.601  -1.645  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.122  -1.167  -2.743  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.629  -1.321  -2.390  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -1.986  -2.240  -2.884  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.292  -0.313  -4.013  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.244  -1.171  -5.290  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.576  -1.860  -5.585  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.769  -3.044  -5.335  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.532  -1.146  -6.152  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.327   0.318  -1.763  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.517  -2.162  -2.940  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.238   0.191  -3.969  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.492   0.429  -4.053  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.993  -0.539  -6.120  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -3.458  -1.923  -5.205  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.389  -0.184  -6.408  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.392  -1.635  -6.335  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.074  -0.459  -1.528  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.716  -0.631  -0.993  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.631  -1.766   0.044  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.295  -2.579  -0.004  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.221   0.703  -0.417  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.148   0.652   0.194  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.319   0.664  -0.482  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.508   0.564   1.606  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.371   0.560   0.411  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.928   0.515   1.710  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.779   0.524   2.812  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.599   0.445   2.938  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.439   0.433   4.053  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.842   0.407   4.120  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.624   0.343  -1.242  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.052  -0.908  -1.813  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.206   1.425  -1.211  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.921   1.044   0.344  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.412   0.733  -1.558  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.360   0.536   0.156  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.299   0.571   2.773  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.679   0.418   2.961  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.862   0.400   4.966  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.334   0.360   5.081  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.600  -1.860   0.967  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.641  -2.932   1.963  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.847  -4.319   1.342  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.144  -5.248   1.742  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.710  -2.645   3.033  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.301  -1.579   4.069  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.475  -1.323   5.018  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.093  -2.007   4.914  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.316  -1.137   0.994  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.666  -2.978   2.445  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.600  -2.308   2.537  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.921  -3.571   3.572  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.061  -0.649   3.560  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.343  -0.992   4.449  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.725  -2.237   5.560  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.211  -0.549   5.739  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.270  -2.989   5.354  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.195  -2.045   4.300  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.922  -1.286   5.712  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.753  -4.481   0.360  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.024  -5.791  -0.269  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.796  -6.427  -0.937  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.719  -7.648  -1.030  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.224  -5.697  -1.232  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -3.930  -5.009  -2.577  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -3.682  -5.986  -3.736  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -3.494  -5.199  -5.039  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -4.563  -5.483  -6.023  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.321  -3.675   0.097  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.309  -6.478   0.529  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.565  -6.694  -1.436  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -5.019  -5.143  -0.731  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.769  -4.390  -2.830  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -3.062  -4.368  -2.469  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -2.799  -6.562  -3.536  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -4.524  -6.674  -3.818  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -3.502  -4.150  -4.813  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -2.511  -5.439  -5.457  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -4.621  -6.474  -6.211  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -5.442  -5.124  -5.657  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -4.382  -4.983  -6.881  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.828  -5.607  -1.355  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.466  -6.016  -1.905  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.481  -6.464  -0.832  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.545  -6.971  -1.194  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.033  -4.839  -2.724  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.672  -4.906  -4.210  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9      -0.532  -5.051  -4.522  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.627  -4.815  -5.017  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.010  -4.616  -1.291  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.319  -6.867  -2.574  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.644  -3.924  -2.320  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.116  -4.837  -2.650  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.185  -6.278   0.464  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.060  -6.618   1.593  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.628  -5.412   2.353  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.496  -5.594   3.208  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.265  -5.908   0.693  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.486  -7.214   2.304  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.897  -7.228   1.252  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.172  -4.187   2.055  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.626  -2.967   2.723  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.157  -2.802   2.654  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.710  -2.829   1.551  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.481  -4.089   1.319  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.164  -2.109   2.237  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.280  -2.997   3.753  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.871  -2.651   3.794  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.333  -2.533   3.806  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.058  -3.729   3.165  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.139  -3.562   2.601  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.740  -2.387   5.279  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.460  -1.952   5.987  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.362  -2.615   5.160  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.611  -1.626   3.267  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.091  -3.323   5.670  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.531  -1.647   5.403  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.443  -2.302   7.001  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.358  -0.867   5.929  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.173  -3.609   5.516  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.440  -2.042   5.246  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.463  -4.929   3.205  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.049  -6.179   2.704  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.897  -6.369   1.185  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.025  -7.488   0.697  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.458  -7.371   3.472  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.763  -7.264   4.850  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.535  -4.999   3.613  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.121  -6.159   2.903  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.393  -7.382   3.344  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.880  -8.302   3.093  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.707  -7.394   4.970  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.637  -5.290   0.434  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.389  -5.315  -1.015  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.332  -4.405  -1.823  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.082  -4.123  -2.993  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.914  -4.993  -1.265  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.431  -5.743  -2.358  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.509  -4.415   0.930  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.562  -6.329  -1.378  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.344  -5.236  -0.389  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.778  -3.934  -1.457  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.714  -6.324  -1.987  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.419  -3.920  -1.202  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.451  -3.116  -1.870  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.984  -1.725  -2.316  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.539  -1.177  -3.267  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.573  -4.210  -0.246  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.297  -2.987  -1.194  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.805  -3.652  -2.752  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.956  -1.164  -1.660  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.289   0.084  -2.054  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.855   0.916  -0.829  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.222   0.366   0.076  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.110  -0.243  -2.994  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.046  -1.171  -2.378  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.923  -1.592  -3.338  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.251  -2.811  -4.100  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.859  -2.914  -5.274  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       5.289  -1.864  -5.937  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.035  -4.095  -5.809  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.579  -1.676  -0.874  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.009   0.663  -2.630  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.634   0.678  -3.269  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.524  -0.720  -3.880  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.538  -2.059  -2.031  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.579  -0.652  -1.549  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.033  -1.774  -2.766  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.669  -0.765  -4.003  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.963  -3.694  -3.698  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.150  -0.962  -5.521  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       5.761  -1.962  -6.815  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.649  -4.894  -5.327  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       5.508  -4.205  -6.684  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.156   2.230  -0.780  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.782   3.088   0.345  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.261   3.331   0.395  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.586   3.165  -0.624  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.554   4.394   0.119  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.677   4.474  -1.401  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.820   3.010  -1.816  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.107   2.628   1.279  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.009   5.234   0.505  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.548   4.308   0.561  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.800   4.914  -1.836  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.540   5.066  -1.707  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.349   2.844  -2.766  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.876   2.739  -1.855  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.710   3.739   1.555  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.287   4.031   1.686  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.901   5.305   0.913  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.684   6.256   0.871  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.035   4.190   3.187  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.385   4.655   3.729  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.393   3.949   2.823  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.719   3.181   1.316  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.274   4.924   3.372  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.781   3.223   3.618  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.482   5.721   3.654  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.518   4.377   4.775  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.262   4.562   2.682  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.662   2.983   3.253  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.688   5.360   0.336  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.185   6.543  -0.353  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.715   7.607   0.655  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.124   7.324   1.513  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.048   6.014  -1.229  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.519   4.852  -0.412  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.716   4.275   0.272  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.961   6.966  -0.991  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.697   6.770  -1.389  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.463   5.630  -2.162  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.232   5.201   0.310  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.019   4.114  -1.041  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.470   3.937   1.260  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.121   3.461  -0.329  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.271   8.822   0.549  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.852  10.027   1.285  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.406  10.657   0.683  1.00  0.00           C  
+ATOM    296  O   SER A  20      -0.387  10.916  -0.540  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.972  11.071   1.284  1.00  0.00           C  
+ATOM    298  OG  SER A  20       3.120  10.541   1.911  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.341  10.903   1.473  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.969   8.961  -0.165  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.601   9.760   2.310  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.210  11.338   0.272  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.636  11.959   1.824  1.00  0.00           H  
+ATOM    304  HG  SER A  20       2.831  10.040   2.676  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        2                                                                  
+ATOM      1  N   ASN A   1      -6.919   6.901   0.917  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.682   6.025  -0.010  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.840   4.889  -0.589  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.106   3.741  -0.253  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.428   6.847  -1.072  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.504   7.659  -0.362  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.180   8.568   0.382  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.768   7.290  -0.468  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.513   6.358   1.667  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.191   7.398   0.422  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.553   7.592   1.308  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.451   5.523   0.581  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.743   7.506  -1.571  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.886   6.189  -1.811  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.078   6.519  -1.037  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.417   7.848   0.064  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.819   5.175  -1.412  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.020   4.162  -2.130  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.244   3.179  -1.224  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.761   2.148  -1.693  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.073   4.863  -3.128  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.831   5.608  -4.250  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -5.010   7.109  -3.963  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.110   5.465  -5.592  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.631   6.133  -1.665  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.709   3.545  -2.710  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.472   5.572  -2.591  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.451   4.089  -3.583  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.820   5.160  -4.359  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.173   7.303  -2.907  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.124   7.663  -4.273  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -5.867   7.480  -4.526  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.114   5.904  -5.535  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.023   4.410  -5.855  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.683   5.969  -6.371  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.181   3.456   0.082  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.537   2.636   1.105  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.038   1.181   1.139  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.259   0.273   1.413  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.727   3.313   2.471  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.520   3.154   3.365  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.382   2.007   4.169  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.514   4.139   3.357  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.233   1.840   4.963  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.365   3.977   4.149  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.218   2.820   4.947  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.909   2.639   5.687  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.618   4.309   0.378  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.470   2.610   0.881  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.905   4.360   2.315  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.610   2.907   2.968  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.154   1.253   4.165  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.614   5.025   2.743  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.110   0.964   5.579  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.390   4.746   4.148  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.602   3.248   5.433  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.316   0.947   0.804  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.914  -0.393   0.686  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.157  -1.200  -0.382  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.755  -2.338  -0.140  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.421  -0.283   0.330  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.214   0.632   1.300  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.099  -1.670   0.270  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.489   1.191   0.662  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.889   1.753   0.580  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.814  -0.911   1.639  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.477   0.157  -0.667  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.484   0.062   2.168  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.616   1.489   1.603  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.421  -2.428  -0.112  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -8.432  -1.979   1.263  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.967  -1.620  -0.389  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.235   1.742  -0.245  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.180   0.385   0.416  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.973   1.875   1.360  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.948  -0.605  -1.564  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.253  -1.225  -2.692  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.763  -1.444  -2.393  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.186  -2.435  -2.832  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.443  -0.345  -3.944  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.608  -1.157  -5.242  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.950  -0.859  -5.909  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.138   0.164  -6.544  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.941  -1.718  -5.770  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.217   0.365  -1.657  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.707  -2.201  -2.864  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.320   0.258  -3.806  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.591   0.328  -4.050  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.816  -0.901  -5.919  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -4.525  -2.228  -5.051  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.847  -2.590  -5.280  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.781  -1.439  -6.247  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.145  -0.549  -1.610  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.791  -0.749  -1.090  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.713  -1.909  -0.084  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.161  -2.766  -0.210  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.266   0.564  -0.501  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.149   0.501  -0.014  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.254   0.539  -0.795  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.637   0.388   1.358  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.382   0.433  -0.006  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.062   0.366   1.327  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.023   0.313   2.627  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.844   0.308   2.487  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.800   0.231   3.799  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.205   0.246   3.733  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.669   0.277  -1.341  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.144  -1.024  -1.920  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.327   1.320  -1.260  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.903   0.868   0.329  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.260   0.636  -1.868  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.347   0.425  -0.348  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.055   0.327   2.692  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.922   0.297   2.403  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.315   0.170   4.763  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.791   0.201   4.639  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.646  -1.992   0.877  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.701  -3.105   1.831  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.917  -4.465   1.152  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.290  -5.437   1.570  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.777  -2.856   2.905  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.370  -1.808   3.958  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.595  -1.444   4.805  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.255  -2.296   4.897  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.325  -1.238   0.964  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.726  -3.167   2.315  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.670  -2.517   2.417  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.988  -3.793   3.422  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.023  -0.911   3.448  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.368  -1.013   4.171  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.990  -2.337   5.292  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.314  -0.721   5.570  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.674  -2.706   5.816  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.651  -3.072   4.431  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.606  -1.459   5.148  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.727  -4.538   0.081  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.916  -5.759  -0.732  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.597  -6.366  -1.231  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.499  -7.582  -1.342  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.803  -5.459  -1.952  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.289  -5.218  -1.653  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.117  -6.512  -1.588  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.591  -6.248  -1.927  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.242  -5.337  -0.956  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.244  -3.695  -0.159  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.390  -6.527  -0.119  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.417  -4.581  -2.432  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.718  -6.282  -2.665  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.369  -4.715  -0.708  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.682  -4.593  -2.456  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.718  -7.218  -2.290  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.028  -6.959  -0.595  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.646  -5.806  -2.903  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -8.119  -7.204  -1.955  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.219  -5.741  -0.030  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.756  -4.452  -0.934  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.207  -5.176  -1.217  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.598  -5.528  -1.520  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.739  -5.926  -1.971  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.608  -6.494  -0.823  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.705  -7.002  -1.069  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.387  -4.675  -2.604  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.379  -4.929  -3.745  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       2.947  -6.037  -3.844  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.565  -3.967  -4.523  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.766  -4.537  -1.399  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.643  -6.697  -2.737  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.598  -4.057  -2.988  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.882  -4.089  -1.828  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.186  -6.365   0.446  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.973  -6.740   1.632  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.532  -5.564   2.451  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.354  -5.783   3.347  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.256  -5.985   0.605  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.333  -7.328   2.291  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.812  -7.373   1.342  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.105  -4.325   2.171  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.505  -3.133   2.918  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.031  -2.908   2.926  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.638  -2.849   1.855  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.516  -4.204   1.357  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.038  -2.263   2.459  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.123  -3.226   3.932  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.693  -2.777   4.097  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.148  -2.595   4.163  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.957  -3.724   3.506  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.099  -3.504   3.110  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.499  -2.497   5.652  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.185  -2.111   6.326  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.127  -2.769   5.441  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.400  -1.655   3.673  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.853  -3.440   6.022  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.273  -1.749   5.829  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.140  -2.494   7.327  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.066  -1.027   6.297  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.932  -3.771   5.772  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.200  -2.199   5.491  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.381  -4.927   3.375  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.056  -6.106   2.818  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.017  -6.159   1.275  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.448  -7.142   0.680  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.474  -7.366   3.479  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.471  -8.354   3.649  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.406  -5.030   3.647  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.108  -6.044   3.095  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.071  -7.105   4.439  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.651  -7.761   2.885  1.00  0.00           H  
+ATOM    208  HG  SER A  13       8.161  -8.011   4.225  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.529  -5.095   0.619  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.302  -5.007  -0.834  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.350  -4.180  -1.591  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.202  -3.947  -2.792  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.935  -4.369  -1.091  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.965  -4.957  -0.265  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.105  -4.361   1.178  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.289  -6.011  -1.260  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.989  -3.318  -0.882  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.656  -4.489  -2.138  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.647  -5.806  -0.666  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.373  -3.654  -0.908  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.445  -2.839  -1.497  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.049  -1.393  -1.840  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.855  -0.483  -1.659  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.407  -3.857   0.081  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.287  -2.809  -0.807  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.786  -3.320  -2.417  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.819  -1.163  -2.323  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.267   0.167  -2.623  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.861   0.912  -1.332  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.127   0.334  -0.526  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.068  -0.003  -3.571  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.414   1.333  -3.977  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.325   1.183  -5.049  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.153   0.425  -4.574  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       2.950  -0.885  -4.652  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.781  -1.719  -5.224  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       1.882  -1.432  -4.137  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.253  -1.991  -2.486  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.044   0.730  -3.139  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.405  -0.501  -4.460  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.323  -0.632  -3.081  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       4.972   1.774  -3.104  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.184   1.994  -4.374  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.002   2.161  -5.348  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.750   0.718  -5.940  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       2.420   0.960  -4.143  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.628  -1.423  -5.666  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.523  -2.718  -5.142  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       1.142  -0.941  -3.681  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       1.880  -2.460  -4.219  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.251   2.191  -1.139  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.871   2.981   0.038  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.351   3.255   0.119  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.652   3.132  -0.890  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.673   4.286  -0.077  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.906   4.435  -1.577  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.086   2.989  -2.028  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.180   2.447   0.936  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.111   5.116   0.307  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.633   4.169   0.430  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.061   4.889  -2.058  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.783   5.042  -1.795  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.767   2.872  -3.046  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.129   2.692  -1.905  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.829   3.643   1.300  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.403   3.904   1.495  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.923   5.149   0.722  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.644   6.147   0.672  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.222   4.081   3.006  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.595   4.541   3.490  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.551   3.810   2.554  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.843   3.030   1.174  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.475   4.822   3.217  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.979   3.120   3.459  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.701   5.605   3.396  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.768   4.278   4.535  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.440   4.391   2.399  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.790   2.828   2.968  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.700   5.129   0.152  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.125   6.268  -0.557  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.575   7.306   0.435  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.344   7.009   1.205  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.028   5.669  -1.440  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.475   4.478  -0.625  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.782   3.998   0.106  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.879   6.738  -1.190  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.759   6.379  -1.608  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.474   5.307  -2.369  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.233   4.781   0.071  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.891   3.701  -1.265  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.533   3.683   1.101  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.245   3.191  -0.461  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.145   8.513   0.410  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.696   9.699   1.148  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.231  10.590   0.317  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.174  11.122   0.943  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.911  10.475   1.671  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.908  10.615   0.673  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.010  10.716  -0.908  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.907   8.704  -0.228  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.105   9.384   2.006  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.593  11.450   1.985  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.334   9.927   2.515  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.569  11.243   0.968  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        3                                                                  
+ATOM      1  N   ASN A   1      -6.589   7.754  -0.571  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.389   6.514  -0.405  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.780   5.255  -1.052  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.487   4.266  -1.200  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.845   6.767  -0.857  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.521   7.797   0.047  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.922   8.257   1.009  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.737   8.213  -0.242  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.686   7.665  -0.127  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.476   7.977  -1.550  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.086   8.512  -0.117  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.439   6.298   0.664  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.842   7.132  -1.866  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.424   5.843  -0.797  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.261   7.891  -1.039  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.125   8.874   0.414  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.480   5.231  -1.392  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.832   4.056  -2.001  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.184   3.091  -0.988  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.640   2.061  -1.389  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.822   4.536  -3.062  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.511   4.943  -4.385  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.400   6.448  -4.640  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.900   4.181  -5.563  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.873   6.022  -1.250  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.585   3.455  -2.516  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.291   5.384  -2.674  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.120   3.726  -3.266  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.571   4.692  -4.345  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.890   6.998  -3.839  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.352   6.744  -4.701  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.890   6.694  -5.582  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.824   4.351  -5.605  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.093   3.114  -5.443  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.353   4.513  -6.498  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.252   3.387   0.316  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.584   2.609   1.367  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.003   1.131   1.375  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.167   0.257   1.584  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.828   3.261   2.737  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.625   3.147   3.649  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.431   2.000   4.441  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.668   4.180   3.663  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.274   1.880   5.234  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.512   4.070   4.456  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.306   2.910   5.235  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.828   2.769   5.969  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.725   4.233   0.586  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.512   2.640   1.167  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.053   4.300   2.590  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.698   2.806   3.217  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.165   1.208   4.426  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.819   5.061   3.058  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.103   1.003   5.839  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.213   4.873   4.463  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.448   3.481   5.798  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.279   0.849   1.085  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.832  -0.507   0.951  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.162  -1.250  -0.218  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.774  -2.406  -0.080  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.364  -0.433   0.749  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.090   0.338   1.884  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.975  -1.842   0.631  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.163   1.282   1.326  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.896   1.633   0.934  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.625  -1.065   1.865  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.545   0.087  -0.194  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.556  -0.369   2.543  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.392   0.938   2.466  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.611  -2.347  -0.263  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.710  -2.438   1.506  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.061  -1.773   0.565  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.695   2.037   0.690  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.891   0.720   0.741  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.673   1.781   2.148  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.009  -0.575  -1.365  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.335  -1.103  -2.553  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.863  -1.419  -2.249  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.395  -2.511  -2.553  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.497  -0.107  -3.724  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.929  -0.785  -5.036  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -3.943  -1.843  -5.517  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.193  -3.032  -5.373  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -2.824  -1.457  -6.094  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.260   0.403  -1.368  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.818  -2.043  -2.816  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.239   0.620  -3.454  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.566   0.435  -3.888  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.882  -1.252  -4.881  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.049  -0.026  -5.809  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -2.586  -0.491  -6.238  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -2.170  -2.206  -6.277  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.154  -0.497  -1.588  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.771  -0.717  -1.152  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.632  -1.844  -0.111  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.256  -2.687  -0.229  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.212   0.604  -0.620  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.197   0.514  -0.129  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.296   0.452  -0.915  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.679   0.425   1.247  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.420   0.332  -0.121  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.101   0.324   1.215  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.066   0.422   2.519  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.882   0.249   2.375  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.839   0.334   3.694  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.243   0.260   3.625  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.607   0.391  -1.386  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.178  -1.016  -2.020  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.248   1.329  -1.411  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.841   0.958   0.197  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.289   0.483  -1.998  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.387   0.296  -0.451  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.010   0.498   2.586  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.957   0.179   2.290  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.352   0.341   4.659  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.829   0.212   4.531  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.520  -1.904   0.893  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.537  -3.007   1.858  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.844  -4.359   1.198  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.228  -5.350   1.586  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.520  -2.723   3.008  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.010  -1.728   4.070  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.122  -1.497   5.096  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.775  -2.236   4.826  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.201  -1.155   0.992  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.534  -3.107   2.271  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.422  -2.325   2.584  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.740  -3.665   3.514  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.763  -0.780   3.597  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.006  -1.098   4.599  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.380  -2.437   5.585  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.791  -0.787   5.854  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -0.973  -3.222   5.249  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7       0.080  -2.296   4.155  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.521  -1.546   5.630  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.716  -4.413   0.176  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.930  -5.631  -0.629  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.639  -6.169  -1.261  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.492  -7.384  -1.349  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.989  -5.413  -1.725  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.424  -5.638  -1.230  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.411  -5.713  -2.404  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.685  -4.341  -3.038  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.352  -4.311  -4.482  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.241  -3.572  -0.051  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.274  -6.422   0.036  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.906  -4.405  -2.084  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.797  -6.130  -2.525  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.464  -6.558  -0.680  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.719  -4.846  -0.542  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.003  -6.362  -3.154  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -7.356  -6.108  -2.033  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.726  -4.108  -2.919  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.117  -3.577  -2.500  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.352  -4.135  -4.636  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.602  -5.176  -4.938  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.827  -3.549  -4.942  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.694  -5.301  -1.644  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.627  -5.715  -2.141  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.545  -6.280  -1.027  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.653  -6.733  -1.322  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.362  -4.545  -2.833  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.631  -3.826  -3.974  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9      -0.157  -4.486  -4.688  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.959  -2.631  -4.185  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.905  -4.313  -1.586  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.482  -6.505  -2.880  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.582  -3.813  -2.080  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.279  -4.946  -3.266  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.135  -6.232   0.250  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.917  -6.656   1.417  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.414  -5.500   2.294  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.054  -5.736   3.320  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.200  -5.879   0.438  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.298  -7.304   2.035  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.784  -7.233   1.096  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.142  -4.244   1.916  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.643  -3.083   2.643  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.182  -3.056   2.660  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.791  -3.197   1.594  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.623  -4.089   1.059  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.286  -2.178   2.156  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.244  -3.115   3.654  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.842  -2.900   3.832  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.302  -2.829   3.917  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.030  -4.020   3.276  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.132  -3.843   2.757  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.642  -2.717   5.411  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.352  -2.223   6.059  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.260  -2.809   5.166  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.628  -1.916   3.416  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.925  -3.673   5.809  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.463  -2.016   5.581  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.263  -2.588   7.064  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.314  -1.133   6.017  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.974  -3.782   5.516  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.381  -2.165   5.191  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.424  -5.220   3.257  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.055  -6.413   2.675  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.230  -6.327   1.155  1.00  0.00           C  
+ATOM    201  O   SER A  13       8.109  -6.992   0.615  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.276  -7.683   3.042  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.083  -7.810   2.296  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.479  -5.307   3.613  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.051  -6.506   3.109  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.897  -8.537   2.850  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.031  -7.660   4.105  1.00  0.00           H  
+ATOM    208  HG  SER A  13       5.284  -8.181   1.431  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.424  -5.506   0.464  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.562  -5.254  -0.977  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.683  -4.260  -1.316  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.958  -4.028  -2.492  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.232  -4.754  -1.561  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.689  -5.759  -2.390  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.730  -4.974   0.980  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.816  -6.193  -1.471  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.548  -4.536  -0.764  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.400  -3.866  -2.170  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.898  -6.171  -1.941  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.320  -3.632  -0.318  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.452  -2.715  -0.493  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.088  -1.324  -1.031  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.745  -0.349  -0.674  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.043  -3.844   0.636  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.948  -2.591   0.468  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.165  -3.167  -1.183  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.043  -1.206  -1.866  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.509   0.078  -2.349  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.942   0.905  -1.177  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.183   0.348  -0.380  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.426  -0.188  -3.413  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.953   1.107  -4.102  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.797   0.884  -5.083  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.176  -0.019  -6.186  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.649  -1.200  -6.493  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.626  -1.720  -5.848  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.165  -1.891  -7.482  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.615  -2.078  -2.159  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.337   0.615  -2.807  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.828  -0.848  -4.157  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.573  -0.680  -2.944  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.630   1.797  -3.346  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.793   1.555  -4.637  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.970   0.454  -4.552  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.515   1.851  -5.503  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.943   0.289  -6.761  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.180  -1.223  -5.093  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.231  -2.612  -6.088  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.951  -1.541  -8.001  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.778  -2.789  -7.706  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.224   2.222  -1.082  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.670   3.081  -0.030  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.138   3.240  -0.131  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.571   3.021  -1.206  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.384   4.430  -0.195  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.755   4.460  -1.675  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.084   2.998  -1.964  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.923   2.656   0.942  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.729   5.243   0.053  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.293   4.437   0.408  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.932   4.798  -2.274  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.607   5.114  -1.870  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.877   2.763  -2.990  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.127   2.798  -1.720  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.461   3.639   0.965  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.015   3.863   0.981  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.598   5.121   0.193  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.428   5.993  -0.068  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.645   3.981   2.465  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.916   4.525   3.112  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.026   3.878   2.287  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.518   2.995   0.551  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.825   4.659   2.602  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.430   2.993   2.869  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.957   5.595   3.042  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.983   4.249   4.165  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.870   4.536   2.218  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.309   2.925   2.736  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.304   5.247  -0.167  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.774   6.401  -0.902  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.569   7.659  -0.043  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.515   8.755  -0.597  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.568   5.927  -1.467  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -1.027   4.877  -0.459  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.279   4.224  -0.018  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.443   6.655  -1.727  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.269   6.738  -1.523  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.411   5.458  -2.438  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.528   5.334   0.372  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.691   4.148  -0.918  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.212   3.908   1.005  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.512   3.395  -0.684  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.445   7.509   1.283  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.349   8.586   2.279  1.00  0.00           C  
+ATOM    295  C   SER A  20       1.387   8.402   3.380  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.887   9.446   3.847  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.064   8.699   2.867  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.468   7.515   3.527  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.609   7.229   3.761  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.533   6.584   1.677  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.581   9.535   1.797  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.081   9.509   3.570  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.771   8.923   2.068  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.877   7.386   4.279  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        4                                                                  
+ATOM      1  N   ASN A   1      -7.996   5.298  -0.779  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.990   4.067  -1.611  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.595   3.515  -1.890  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.409   2.326  -1.667  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.817   4.236  -2.891  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.260   4.485  -2.482  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.595   5.590  -2.090  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -11.097   3.465  -2.420  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.499   5.145   0.089  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -7.580   6.071  -1.279  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -8.957   5.549  -0.571  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.483   3.285  -1.032  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.449   5.070  -3.456  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.756   3.334  -3.502  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.855   2.524  -2.688  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.028   3.700  -2.110  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.616   4.322  -2.330  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.255   3.853  -2.649  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.609   2.984  -1.550  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -2.969   1.976  -1.846  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.364   5.074  -2.976  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.035   5.287  -4.464  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -2.298   4.086  -5.067  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.283   5.609  -5.288  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.808   5.284  -2.567  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.324   3.212  -3.525  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.868   5.953  -2.622  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.413   4.965  -2.461  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -2.366   6.146  -4.524  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -1.513   3.750  -4.388  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.985   3.262  -5.255  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -1.840   4.380  -6.010  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -4.988   4.779  -5.260  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.758   6.509  -4.897  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.993   5.793  -6.323  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.829   3.342  -0.280  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.352   2.587   0.881  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.885   1.142   0.933  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.182   0.255   1.410  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.714   3.350   2.166  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.571   3.426   3.153  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.238   2.307   3.939  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.826   4.614   3.277  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.172   2.377   4.854  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.758   4.692   4.190  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.434   3.573   4.988  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.564   3.651   5.909  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.312   4.211  -0.115  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.266   2.531   0.815  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.003   4.349   1.900  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.571   2.877   2.649  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.810   1.398   3.838  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.070   5.479   2.676  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.916   1.531   5.472  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.198   5.613   4.266  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.792   4.562   6.104  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.099   0.891   0.414  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.705  -0.444   0.348  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -4.882  -1.332  -0.589  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.466  -2.411  -0.181  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.191  -0.380  -0.086  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.038   0.622   0.737  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.836  -1.778  -0.048  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.051   0.390   2.254  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.574   1.642  -0.074  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.657  -0.892   1.341  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.230  -0.049  -1.125  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.652   1.607   0.557  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.066   0.590   0.375  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.351  -2.438  -0.767  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.744  -2.214   0.948  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.891  -1.708  -0.312  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.463  -0.592   2.485  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -7.043   0.470   2.659  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.674   1.150   2.725  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.600  -0.857  -1.811  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -3.712  -1.519  -2.775  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.314  -1.759  -2.183  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -1.803  -2.878  -2.255  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -3.634  -0.674  -4.062  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.792  -0.953  -5.031  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.542  -2.214  -5.853  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.848  -3.320  -5.436  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.968  -2.093  -7.036  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -4.948   0.063  -2.038  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.122  -2.500  -3.019  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -3.656   0.364  -3.792  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -2.694  -0.880  -4.579  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.696  -1.078  -4.467  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -4.898  -0.106  -5.710  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.693  -1.205  -7.419  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.810  -2.965  -7.512  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.713  -0.734  -1.561  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.400  -0.841  -0.917  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.353  -1.931   0.171  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.567  -2.757   0.175  1.00  0.00           O  
+ATOM     97  CB  TRP A   6       0.005   0.531  -0.361  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.372   0.565   0.247  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.532   0.625  -0.442  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.747   0.483   1.657  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.594   0.565   0.438  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.169   0.480   1.743  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.032   0.393   2.872  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.853   0.395   2.965  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.707   0.293   4.104  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.112   0.296   4.154  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.186   0.167  -1.566  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.329  -1.126  -1.676  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.024   1.242  -1.164  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.716   0.838   0.395  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.616   0.684  -1.518  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.579   0.565   0.164  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.046   0.398   2.841  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.933   0.389   2.975  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.142   0.218   5.022  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.621   0.223   5.106  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.360  -1.961   1.060  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.529  -3.019   2.059  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.819  -4.386   1.425  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.263  -5.376   1.896  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.645  -2.652   3.058  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.265  -1.546   4.060  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.504  -1.129   4.860  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.186  -1.989   5.054  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.062  -1.224   1.020  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.594  -3.131   2.603  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.499  -2.320   2.500  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.915  -3.543   3.627  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.898  -0.680   3.518  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.273  -0.762   4.181  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.892  -1.977   5.422  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.243  -0.331   5.557  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.516  -2.875   5.597  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.258  -2.212   4.531  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.990  -1.188   5.767  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.636  -4.457   0.360  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.000  -5.710  -0.323  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.774  -6.506  -0.772  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.764  -7.728  -0.650  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.907  -5.437  -1.541  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.842  -6.624  -1.830  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.265  -6.337  -1.328  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.114  -7.612  -1.287  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.875  -8.381  -0.042  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.089  -3.595   0.056  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.534  -6.330   0.396  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.501  -4.566  -1.344  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.287  -5.248  -2.418  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.871  -6.798  -2.888  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -4.454  -7.529  -1.364  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.209  -5.923  -0.340  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.730  -5.625  -2.013  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -8.151  -7.343  -1.337  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.877  -8.220  -2.164  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.889  -8.591   0.053  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.168  -7.840   0.762  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.394  -9.248  -0.055  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.756  -5.802  -1.272  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.519  -6.369  -1.719  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.466  -6.750  -0.552  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.432  -7.481  -0.764  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.147  -5.356  -2.691  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.157  -5.999  -3.643  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.687  -6.708  -4.559  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.367  -5.733  -3.478  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.906  -4.806  -1.394  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.309  -7.281  -2.280  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.365  -4.908  -3.272  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.602  -4.539  -2.136  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.166  -6.322   0.686  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.940  -6.628   1.899  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.455  -5.411   2.687  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.258  -5.576   3.605  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.283  -5.838   0.808  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.308  -7.208   2.569  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.799  -7.243   1.641  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.025  -4.190   2.349  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.501  -2.933   2.929  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.035  -2.809   2.947  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.636  -2.640   1.883  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.426  -4.116   1.535  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.113  -2.118   2.323  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.088  -2.828   3.930  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.714  -2.887   4.112  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.177  -2.830   4.177  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.894  -3.885   3.322  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.009  -3.632   2.870  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.543  -2.996   5.656  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.275  -2.581   6.397  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.158  -3.015   5.451  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.493  -1.842   3.843  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.796  -4.015   5.874  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.390  -2.365   5.930  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.198  -3.086   7.340  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.255  -1.495   6.510  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.876  -4.032   5.645  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.286  -2.377   5.597  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.272  -5.048   3.067  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.859  -6.106   2.234  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.522  -5.983   0.737  1.00  0.00           C  
+ATOM    201  O   SER A  13       6.868  -6.883  -0.022  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.517  -7.490   2.809  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.152  -7.809   2.665  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.336  -5.211   3.432  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.945  -6.021   2.301  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       7.100  -8.230   2.296  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.776  -7.504   3.869  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.960  -7.945   1.731  1.00  0.00           H  
+ATOM    209  N   SER A  14       5.879  -4.888   0.300  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.483  -4.641  -1.100  1.00  0.00           C  
+ATOM    211  C   SER A  14       6.594  -4.035  -1.979  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.388  -3.818  -3.171  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.291  -3.674  -1.143  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.244  -4.095  -0.294  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.551  -4.209   0.982  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.168  -5.582  -1.554  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.621  -2.702  -0.832  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       3.920  -3.612  -2.167  1.00  0.00           H  
+ATOM    219  HG  SER A  14       2.497  -3.486  -0.373  1.00  0.00           H  
+ATOM    220  N   GLY A  15       7.760  -3.685  -1.413  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       8.865  -3.074  -2.168  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.636  -1.615  -2.597  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.329  -1.131  -3.490  1.00  0.00           O  
+ATOM    224  H   GLY A  15       7.882  -3.900  -0.435  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.772  -3.108  -1.566  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.044  -3.662  -3.070  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.674  -0.910  -1.982  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.291   0.476  -2.303  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.926   1.243  -1.019  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.299   0.641  -0.143  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.095   0.409  -3.275  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.718   1.773  -3.872  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.496   1.668  -4.787  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.170   2.979  -5.381  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.620   3.482  -6.525  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       5.433   2.811  -7.310  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.260   4.687  -6.902  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.165  -1.374  -1.242  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.134   0.962  -2.796  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.346  -0.256  -4.078  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.232  -0.006  -2.753  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.497   2.454  -3.073  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.563   2.153  -4.447  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.704   0.968  -5.573  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.644   1.325  -4.197  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.562   3.570  -4.839  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.714   1.890  -7.023  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       5.768   3.197  -8.173  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       3.648   5.240  -6.327  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.602   5.065  -7.766  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.244   2.550  -0.887  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.834   3.351   0.272  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.302   3.529   0.364  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.613   3.423  -0.657  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.546   4.701   0.109  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.773   4.807  -1.398  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.043   3.359  -1.797  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.191   2.864   1.180  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.929   5.505   0.461  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.509   4.667   0.619  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.902   5.190  -1.895  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.614   5.459  -1.638  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.743   3.188  -2.813  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.099   3.130  -1.650  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.761   3.830   1.562  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.330   4.041   1.763  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.857   5.363   1.124  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.561   6.372   1.215  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.122   4.052   3.280  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.467   4.528   3.826  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.475   3.963   2.826  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.789   3.199   1.338  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.336   4.730   3.554  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.928   3.039   3.629  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.513   5.600   3.853  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.649   4.156   4.834  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.306   4.633   2.716  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.808   2.979   3.157  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.664   5.391   0.501  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.089   6.605  -0.071  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.480   7.494   1.027  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.248   6.998   1.889  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.030   6.099  -1.056  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.452   4.787  -0.431  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.776   4.254   0.301  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.850   7.167  -0.612  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.777   6.800  -1.143  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.507   5.887  -2.015  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.258   4.965   0.255  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.783   4.076  -1.188  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.491   3.835   1.247  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.276   3.508  -0.318  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.773   8.801   0.994  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.156   9.787   1.896  1.00  0.00           C  
+ATOM    295  C   SER A  20      -1.215  10.283   1.430  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.579  10.082   0.257  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.058  11.002   2.110  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.393  11.759   3.099  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.809  10.968   2.306  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.346   9.144   0.240  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.001   9.315   2.867  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.029  10.699   2.452  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.131  11.580   1.186  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.584  11.562   2.923  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        5                                                                  
+ATOM      1  N   ASN A   1      -8.175   6.595  -1.658  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.203   6.342  -0.567  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -5.868   5.761  -1.012  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -4.867   6.207  -0.471  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.789   5.475   0.551  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.492   6.367   1.553  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.561   6.874   1.264  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.884   6.637   2.695  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.762   7.177  -2.374  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.486   5.725  -2.069  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -8.985   7.069  -1.275  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.948   7.307  -0.124  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.491   4.779   0.135  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.995   4.925   1.061  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -6.974   6.276   2.941  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.390   7.244   3.321  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.828   4.741  -1.887  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.612   4.045  -2.368  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.979   3.125  -1.303  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.517   2.035  -1.641  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.580   5.040  -2.959  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.147   5.962  -4.067  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.532   7.367  -4.057  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.954   5.329  -5.447  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.690   4.354  -2.239  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.915   3.389  -3.185  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.214   5.658  -2.162  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.734   4.477  -3.358  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.216   6.098  -3.915  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.212   7.650  -3.053  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.676   7.423  -4.729  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.283   8.087  -4.385  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.891   5.203  -5.654  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.442   4.355  -5.483  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.390   5.972  -6.210  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.034   3.507  -0.022  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.488   2.754   1.113  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.999   1.304   1.197  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.219   0.398   1.481  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.764   3.518   2.421  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.555   3.588   3.333  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.195   2.479   4.123  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.776   4.762   3.370  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.050   2.538   4.942  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.643   4.831   4.199  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.268   3.716   4.975  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.867   3.769   5.724  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.320   4.468   0.138  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.408   2.707   0.979  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.066   4.518   2.176  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.590   3.050   2.959  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.793   1.578   4.096  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.027   5.621   2.759  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.776   1.690   5.552  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.044   5.734   4.228  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.327   2.931   5.742  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.288   1.067   0.907  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.894  -0.275   0.884  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.214  -1.162  -0.172  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.782  -2.273   0.130  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.430  -0.201   0.663  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.116   0.772   1.655  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.062  -1.596   0.813  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.454   2.122   1.015  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.869   1.867   0.710  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.718  -0.740   1.855  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.627   0.135  -0.357  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.024   0.321   2.007  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.470   0.935   2.519  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.644  -2.289   0.083  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.885  -1.983   1.817  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.137  -1.535   0.640  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.676   2.427   0.316  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.403   2.047   0.483  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.550   2.876   1.798  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.080  -0.655  -1.404  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.405  -1.359  -2.496  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.908  -1.559  -2.203  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.368  -2.623  -2.496  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.637  -0.594  -3.811  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.176  -1.352  -5.070  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.080  -2.517  -5.485  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.806  -3.119  -4.707  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.067  -2.886  -6.751  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.392   0.289  -1.566  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.856  -2.348  -2.581  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.687  -0.394  -3.904  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -4.096   0.353  -3.763  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.136  -0.654  -5.884  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -3.160  -1.723  -4.932  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.471  -2.439  -7.427  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.746  -3.581  -7.000  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.243  -0.575  -1.581  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.858  -0.716  -1.118  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.699  -1.828  -0.069  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.195  -2.668  -0.194  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.351   0.624  -0.585  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.048   0.578  -0.054  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.171   0.607  -0.807  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.497   0.476   1.333  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.277   0.517   0.018  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.921   0.430   1.339  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.854   0.427   2.590  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.676   0.352   2.517  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.600   0.338   3.783  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.006   0.310   3.748  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.729   0.304  -1.422  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.238  -0.999  -1.969  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.385   1.340  -1.384  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -1.007   0.967   0.214  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.193   0.693  -1.885  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.245   0.568  -0.288  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.224   0.468   2.624  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.754   0.329   2.457  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.091   0.294   4.733  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.573   0.259   4.666  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.582  -1.882   0.939  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.603  -2.983   1.905  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.840  -4.339   1.225  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.195  -5.312   1.611  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.648  -2.725   3.008  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.246  -1.632   4.018  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.417  -1.351   4.965  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.033  -2.033   4.868  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.278  -1.141   1.019  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.618  -3.051   2.362  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.566  -2.428   2.539  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.811  -3.653   3.557  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.009  -0.713   3.490  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.299  -1.072   4.387  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.642  -2.240   5.555  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.161  -0.532   5.635  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.219  -2.989   5.358  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.146  -2.116   4.244  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.847  -1.273   5.626  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.685  -4.402   0.182  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.936  -5.625  -0.601  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.667  -6.232  -1.217  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.582  -7.450  -1.336  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.985  -5.346  -1.693  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.692  -6.641  -2.114  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.718  -6.428  -3.232  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.032  -6.294  -4.599  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -5.771  -7.040  -5.645  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.211  -3.559  -0.040  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.336  -6.373   0.084  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.713  -4.655  -1.313  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.500  -4.897  -2.560  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -3.952  -7.338  -2.457  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.210  -7.046  -1.244  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.387  -7.266  -3.257  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.315  -5.536  -3.029  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -4.993  -5.257  -4.871  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -4.012  -6.679  -4.526  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.793  -8.024  -5.407  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.721  -6.700  -5.709  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -5.316  -6.938  -6.542  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.684  -5.400  -1.577  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.625  -5.836  -2.086  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.499  -6.498  -0.998  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.414  -7.249  -1.327  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.344  -4.617  -2.703  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.032  -4.934  -4.036  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.293  -5.094  -5.034  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.282  -4.935  -4.072  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.848  -4.407  -1.477  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.459  -6.576  -2.871  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.621  -3.842  -2.868  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.073  -4.222  -1.993  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.197  -6.249   0.290  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.964  -6.697   1.458  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.454  -5.562   2.375  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.219  -5.821   3.307  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.340  -5.733   0.471  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.338  -7.359   2.052  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.839  -7.260   1.131  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.062  -4.303   2.120  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.530  -3.141   2.879  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.060  -2.973   2.802  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.611  -3.075   1.699  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.492  -4.143   1.300  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.070  -2.244   2.466  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.200  -3.255   3.909  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.771  -2.727   3.926  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.226  -2.519   3.940  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.037  -3.646   3.278  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.097  -3.395   2.709  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.621  -2.378   5.418  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.327  -1.974   6.119  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.247  -2.658   5.284  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.447  -1.585   3.423  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.987  -3.310   5.804  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.399  -1.626   5.554  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.312  -2.328   7.132  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.205  -0.892   6.065  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.054  -3.644   5.660  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.323  -2.082   5.337  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.521  -4.880   3.304  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.176  -6.096   2.804  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.053  -6.286   1.281  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.203  -7.401   0.787  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.621  -7.302   3.574  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.881  -7.134   4.956  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.621  -5.007   3.748  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.242  -6.031   3.029  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.562  -7.373   3.414  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.106  -8.216   3.229  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.464  -7.849   5.442  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.792  -5.202   0.538  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.428  -5.207  -0.894  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.386  -4.379  -1.769  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.101  -4.123  -2.941  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.978  -4.731  -1.093  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.172  -4.953   0.037  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.675  -4.342   1.057  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.470  -6.235  -1.257  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.988  -3.679  -1.305  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.551  -5.239  -1.956  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.342  -4.220   0.679  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.502  -3.913  -1.182  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.546  -3.129  -1.849  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.114  -1.724  -2.287  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.680  -1.186  -3.235  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.649  -4.194  -0.222  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.391  -3.019  -1.170  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.893  -3.670  -2.730  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.100  -1.139  -1.630  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.450   0.119  -2.030  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.928   0.911  -0.816  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.269   0.321   0.044  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.317  -0.179  -3.034  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.288  -1.191  -2.504  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.285  -1.659  -3.553  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.933  -2.527  -4.549  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.527  -2.735  -5.794  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.493  -2.100  -6.302  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.167  -3.578  -6.566  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.708  -1.640  -0.844  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.196   0.717  -2.550  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.809   0.739  -3.257  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.768  -0.575  -3.945  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.817  -2.049  -2.135  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.734  -0.757  -1.678  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.499  -2.206  -3.068  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.837  -0.783  -4.024  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.648  -3.155  -4.195  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.947  -1.544  -5.671  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.153  -2.320  -7.218  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.883  -4.149  -6.152  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.831  -3.768  -7.490  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.167   2.235  -0.738  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.698   3.071   0.368  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.171   3.287   0.323  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.562   3.090  -0.732  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.457   4.393   0.202  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.658   4.498  -1.308  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.864   3.045  -1.729  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.972   2.607   1.317  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.878   5.217   0.571  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.428   4.317   0.695  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.793   4.919  -1.784  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.520   5.115  -1.561  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.450   2.878  -2.705  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.927   2.802  -1.714  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.543   3.703   1.441  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.105   3.956   1.499  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.686   5.190   0.673  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.440   6.163   0.597  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.777   4.132   2.983  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.091   4.608   3.598  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.149   3.902   2.752  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.585   3.075   1.131  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.005   4.865   3.119  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.506   3.167   3.411  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.187   5.674   3.523  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.169   4.334   4.651  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.028   4.511   2.668  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.384   2.932   3.191  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.485   5.179   0.063  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.959   6.296  -0.711  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.308   7.346   0.205  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.866   7.217   0.563  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.038   5.662  -1.685  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.611   4.494  -0.880  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.571   4.046  -0.020  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.758   6.771  -1.284  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.808   6.358  -1.956  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.500   5.276  -2.551  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.432   4.815  -0.268  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.960   3.695  -1.533  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.232   3.772   0.961  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.080   3.221  -0.514  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.081   8.389   0.531  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.712   9.526   1.401  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.588   9.160   2.890  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.262  10.095   3.652  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -0.566  10.221   0.907  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -0.448  10.583  -0.457  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.841   7.989   3.253  1.00  0.00           O  
+ATOM    300  H   SER A  20       2.044   8.336   0.235  1.00  0.00           H  
+ATOM    301  HA  SER A  20       1.510  10.263   1.347  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.397   9.552   1.023  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -0.739  11.118   1.507  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.325  10.595  -0.845  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        6                                                                  
+ATOM      1  N   ASN A   1      -8.386   5.528   0.323  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.252   6.475   0.201  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -5.976   5.793  -0.320  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -4.928   5.981   0.279  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.989   7.168   1.563  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.182   7.971   2.069  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.321   7.671   1.737  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.956   8.989   2.877  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.680   5.191  -0.583  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.133   4.750   0.917  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.162   6.024   0.757  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.519   7.256  -0.513  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -6.753   6.414   2.289  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.141   7.847   1.464  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.025   9.245   3.168  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.768   9.497   3.186  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.033   4.992  -1.399  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.893   4.279  -2.026  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.189   3.209  -1.150  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.787   2.161  -1.653  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.898   5.323  -2.592  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.403   5.048  -4.026  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.520   5.284  -5.049  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.245   5.991  -4.373  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.896   4.918  -1.915  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.303   3.724  -2.868  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.382   6.281  -2.586  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.041   5.381  -1.923  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.055   4.018  -4.106  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.356   4.614  -4.868  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.864   6.318  -4.993  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.141   5.093  -6.053  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.447   7.000  -4.006  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.330   5.621  -3.919  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -2.089   6.031  -5.450  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.112   3.429   0.165  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.496   2.595   1.193  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.014   1.148   1.203  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.249   0.231   1.485  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.710   3.279   2.555  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.553   3.084   3.510  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.456   1.903   4.268  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.561   4.078   3.620  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.355   1.701   5.120  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.454   3.878   4.467  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.345   2.682   5.210  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.737   2.459   6.003  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.356   4.372   0.451  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.424   2.563   0.995  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.843   4.331   2.391  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.629   2.908   3.015  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.225   1.149   4.184  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.654   5.000   3.056  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.263   0.796   5.701  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.299   4.646   4.556  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.435   3.096   5.844  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.288   0.927   0.844  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.882  -0.413   0.700  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.155  -1.216  -0.392  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.783  -2.368  -0.166  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.403  -0.333   0.415  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.165   0.597   1.397  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.025  -1.739   0.474  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.569   1.925   0.742  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.849   1.736   0.639  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.742  -0.945   1.643  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.545   0.041  -0.602  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.051   0.094   1.733  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.558   0.797   2.280  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.561  -2.398  -0.261  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.892  -2.168   1.469  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.091  -1.683   0.250  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.690   2.447   0.367  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.256   1.730  -0.083  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.076   2.550   1.478  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.919  -0.602  -1.563  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.148  -1.213  -2.650  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.698  -1.477  -2.220  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.176  -2.563  -2.456  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.189  -0.338  -3.923  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.048  -0.952  -5.043  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.557  -0.530  -6.426  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -3.843  -1.254  -7.098  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.900   0.648  -6.907  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.147   0.379  -1.642  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.590  -2.184  -2.870  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.595   0.621  -3.666  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.171  -0.226  -4.301  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.003  -2.022  -4.969  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.090  -0.657  -4.912  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -5.491   1.299  -6.420  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -4.516   0.824  -7.820  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.058  -0.514  -1.548  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.698  -0.699  -1.033  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.598  -1.819   0.024  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.351  -2.603   0.007  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.182   0.633  -0.487  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.208   0.559   0.054  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.340   0.584  -0.684  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.636   0.399   1.441  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.434   0.426   0.145  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.060   0.338   1.464  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.968   0.306   2.680  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.793   0.231   2.652  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.692   0.176   3.881  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.098   0.160   3.871  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.537   0.370  -1.411  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.056  -0.999  -1.865  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.199   1.355  -1.281  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.845   0.977   0.306  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.372   0.691  -1.760  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.406   0.397  -0.171  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.111   0.343   2.699  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.871   0.201   2.617  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.165   0.101   4.820  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.644   0.086   4.800  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.583  -1.947   0.921  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.656  -3.076   1.851  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.870  -4.413   1.124  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.239  -5.396   1.507  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.744  -2.838   2.914  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.336  -1.840   4.014  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.558  -1.525   4.882  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.236  -2.386   4.934  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.308  -1.232   0.953  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.691  -3.164   2.348  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.619  -2.459   2.422  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.984  -3.790   3.391  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.981  -0.918   3.559  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.336  -1.072   4.269  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.942  -2.440   5.333  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.281  -0.829   5.675  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.580  -3.296   5.429  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.333  -2.606   4.369  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.987  -1.645   5.691  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.686  -4.452   0.056  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.868  -5.634  -0.809  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.553  -6.182  -1.385  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.446  -7.398  -1.524  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.855  -5.315  -1.947  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.312  -5.718  -1.691  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.595  -7.194  -2.011  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.083  -7.358  -2.351  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.467  -8.781  -2.499  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.201  -3.604  -0.166  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.277  -6.443  -0.202  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.830  -4.256  -2.119  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.518  -5.782  -2.874  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.538  -5.544  -0.657  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.933  -5.099  -2.340  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -4.999  -7.501  -2.849  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.322  -7.812  -1.153  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.668  -6.922  -1.564  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.274  -6.823  -3.286  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -6.831  -9.251  -3.130  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.436  -9.244  -1.601  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.406  -8.854  -2.869  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.560  -5.331  -1.687  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.784  -5.780  -2.096  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.568  -6.488  -0.965  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.503  -7.234  -1.258  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.632  -4.594  -2.600  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.231  -4.011  -3.959  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.430  -4.722  -4.969  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.856  -2.815  -4.003  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.747  -4.339  -1.618  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.686  -6.498  -2.912  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.563  -3.808  -1.872  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.656  -4.948  -2.713  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.199  -6.278   0.311  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.937  -6.750   1.490  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.431  -5.639   2.432  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.200  -5.926   3.352  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.336  -5.769   0.474  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.286  -7.408   2.066  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.807  -7.329   1.179  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.031  -4.376   2.219  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.470  -3.241   3.034  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.000  -3.062   3.006  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.575  -3.113   1.914  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.469  -4.186   1.397  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.015  -2.334   2.636  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.114  -3.391   4.051  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.686  -2.853   4.152  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.138  -2.627   4.199  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.979  -3.705   3.499  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.023  -3.398   2.928  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.504  -2.546   5.686  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.198  -2.156   6.370  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.133  -2.817   5.498  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.351  -1.666   3.730  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.853  -3.495   6.045  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.286  -1.807   5.866  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.162  -2.534   7.374  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.079  -1.073   6.340  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.931  -3.812   5.845  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.207  -2.241   5.544  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.508  -4.958   3.493  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.189  -6.103   2.872  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.058  -6.147   1.336  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.435  -7.142   0.722  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.693  -7.403   3.522  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.056  -7.403   4.891  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.629  -5.143   3.955  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.255  -6.026   3.087  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.625  -7.465   3.433  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.159  -8.260   3.034  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.918  -8.284   5.253  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.545  -5.077   0.709  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.283  -4.978  -0.737  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.371  -4.237  -1.526  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.218  -4.034  -2.732  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.974  -4.222  -0.999  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.964  -4.544  -0.082  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.237  -4.313   1.299  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.178  -5.981  -1.151  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.169  -3.169  -0.937  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.638  -4.447  -2.011  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.139  -4.000   0.726  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.414  -3.725  -0.859  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.471  -2.894  -1.454  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.041  -1.455  -1.795  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.819  -0.525  -1.599  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.450  -3.903   0.136  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.311  -2.842  -0.764  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.822  -3.367  -2.372  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.814  -1.262  -2.297  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.226   0.051  -2.611  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.816   0.830  -1.338  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.195   0.243  -0.447  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.050  -0.120  -3.595  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       4.880  -0.960  -3.052  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.737  -1.115  -4.058  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.012  -2.181  -5.038  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.322  -2.423  -6.147  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       2.338  -1.649  -6.533  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       3.618  -3.461  -6.892  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.281  -2.107  -2.474  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.002   0.620  -3.123  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.676   0.855  -3.843  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.426  -0.587  -4.506  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.248  -1.936  -2.800  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.474  -0.469  -2.174  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       2.836  -1.356  -3.526  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.570  -0.162  -4.563  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.727  -2.848  -4.801  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       1.964  -1.052  -5.816  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       1.772  -1.893  -7.322  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.226  -4.165  -6.517  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.002  -3.699  -7.645  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.097   2.147  -1.240  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.733   2.965  -0.077  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.211   3.205   0.012  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.514   3.057  -0.995  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.499   4.279  -0.266  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.601   4.413  -1.783  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.764   2.966  -2.245  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.073   2.472   0.834  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.958   5.103   0.157  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.500   4.183   0.158  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.711   4.851  -2.192  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.451   5.031  -2.080  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.305   2.827  -3.205  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.823   2.707  -2.277  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.682   3.595   1.190  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.257   3.860   1.368  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.815   5.129   0.616  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.586   6.086   0.526  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.049   4.007   2.879  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.407   4.496   3.377  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.393   3.792   2.447  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.691   3.004   1.010  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.280   4.725   3.093  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.830   3.031   3.313  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.488   5.562   3.288  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.575   4.231   4.423  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.262   4.402   2.293  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.666   2.823   2.864  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.564   5.179   0.116  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.048   6.326  -0.630  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.603   7.495   0.262  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.510   8.619  -0.227  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.136   5.763  -1.415  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.683   4.666  -0.501  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.585   4.100   0.134  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.801   6.695  -1.328  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.875   6.521  -1.589  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.239   5.311  -2.333  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.340   5.073   0.243  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.221   3.904  -1.064  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.390   3.791   1.143  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.959   3.279  -0.477  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.367   7.228   1.556  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.233   8.139   2.544  1.00  0.00           C  
+ATOM    295  C   SER A  20      -1.656   8.585   2.160  1.00  0.00           C  
+ATOM    296  O   SER A  20      -2.384   7.708   1.628  1.00  0.00           O  
+ATOM    297  CB  SER A  20       0.737   9.297   2.810  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.750   9.605   4.190  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -2.026   9.739   2.451  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.453   6.262   1.817  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.350   7.592   3.476  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.724   9.013   2.499  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.448  10.165   2.214  1.00  0.00           H  
+ATOM    304  HG  SER A  20       0.692  10.559   4.282  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        7                                                                  
+ATOM      1  N   ASN A   1      -8.903   5.528  -0.196  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.549   5.998  -0.581  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.760   4.831  -1.189  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.247   3.705  -1.144  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.831   6.647   0.620  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -5.684   7.538   0.154  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -4.583   7.063  -0.078  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -5.924   8.815  -0.078  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -9.364   5.129  -1.005  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.821   4.800   0.502  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.457   6.290   0.168  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.661   6.757  -1.358  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.535   7.240   1.171  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.437   5.876   1.282  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -6.803   9.269   0.111  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -5.123   9.345  -0.388  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.566   5.065  -1.745  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.705   4.017  -2.308  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.063   3.108  -1.244  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.570   2.036  -1.587  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.636   4.665  -3.218  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.984   4.537  -4.715  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.137   5.490  -5.557  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.737   3.110  -5.216  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.153   5.991  -1.653  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.332   3.363  -2.913  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.557   5.706  -2.970  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.666   4.195  -3.051  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.035   4.787  -4.864  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.377   6.522  -5.297  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.077   5.308  -5.382  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.356   5.339  -6.615  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.687   2.842  -5.096  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.350   2.412  -4.658  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.007   3.032  -6.270  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.102   3.487   0.042  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.503   2.730   1.149  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.977   1.265   1.216  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.168   0.369   1.448  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.768   3.466   2.474  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.672   3.279   3.509  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.536   2.057   4.196  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.783   4.339   3.784  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.523   1.895   5.162  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.765   4.177   4.741  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.640   2.961   5.441  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.309   2.837   6.407  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.453   4.414   0.232  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.424   2.713   0.990  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.861   4.514   2.266  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.720   3.136   2.894  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.211   1.241   3.988  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.890   5.287   3.275  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.418   0.959   5.689  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.083   4.982   4.975  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.037   2.243   7.107  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.269   1.004   0.959  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.833  -0.356   0.888  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.161  -1.164  -0.238  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.772  -2.318  -0.049  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.371  -0.313   0.696  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.110   0.552   1.752  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.954  -1.737   0.753  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.509   1.938   1.232  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.872   1.790   0.762  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.619  -0.864   1.831  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.587   0.085  -0.297  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.999   0.033   2.055  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.496   0.664   2.647  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.517  -2.368  -0.021  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.761  -2.183   1.729  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.031  -1.704   0.581  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.626   2.563   1.121  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.024   1.846   0.274  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.188   2.410   1.945  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.003  -0.544  -1.411  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.375  -1.125  -2.597  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.869  -1.353  -2.405  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.354  -2.357  -2.886  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.661  -0.216  -3.809  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.379  -0.927  -4.966  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.417  -1.485  -6.011  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.226  -0.906  -7.068  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.781  -2.614  -5.772  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.256   0.433  -1.455  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.826  -2.102  -2.768  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.275   0.600  -3.481  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.731   0.222  -4.174  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.955  -1.738  -4.564  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.017  -0.197  -5.466  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.799  -3.091  -4.886  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.166  -2.885  -6.520  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.181  -0.471  -1.666  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.803  -0.688  -1.216  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.702  -1.871  -0.236  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.137  -2.753  -0.420  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.253   0.612  -0.609  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.148   0.524  -0.079  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.275   0.502  -0.828  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.590   0.428   1.311  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.377   0.391   0.000  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.013   0.346   1.324  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.937   0.410   2.563  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.756   0.265   2.509  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.672   0.321   3.762  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.077   0.254   3.738  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.666   0.378  -1.389  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.189  -0.942  -2.080  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.274   1.369  -1.369  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.902   0.932   0.205  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.303   0.552  -1.909  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.354   0.366  -0.301  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.141   0.482   2.594  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.833   0.212   2.461  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.154   0.320   4.711  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.633   0.202   4.663  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.584  -1.939   0.773  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.618  -3.061   1.719  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.896  -4.418   1.055  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.383  -5.420   1.551  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.638  -2.803   2.843  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.158  -1.828   3.935  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.332  -1.509   4.865  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.029  -2.411   4.793  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.238  -1.169   0.902  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.625  -3.152   2.159  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.528  -2.398   2.401  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.875  -3.753   3.326  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.813  -0.903   3.475  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.138  -1.046   4.295  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.701  -2.424   5.328  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.014  -0.822   5.647  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.366  -3.322   5.290  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.162  -2.644   4.181  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.726  -1.685   5.547  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.649  -4.469  -0.060  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.926  -5.712  -0.805  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.673  -6.493  -1.213  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.747  -7.718  -1.261  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.745  -5.435  -2.077  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.245  -5.187  -1.834  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.112  -6.160  -2.652  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.013  -7.607  -2.144  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.775  -7.803  -0.889  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.091  -3.603  -0.351  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.486  -6.385  -0.157  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.336  -4.566  -2.556  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.629  -6.287  -2.748  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.457  -5.322  -0.791  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.483  -4.171  -2.145  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -7.135  -5.843  -2.591  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.787  -6.129  -3.694  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.405  -8.266  -2.895  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -4.957  -7.857  -1.989  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -6.431  -7.175  -0.174  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.755  -7.610  -1.046  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.676  -8.755  -0.564  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.575  -5.806  -1.542  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.679  -6.439  -1.960  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.407  -7.073  -0.759  1.00  0.00           C  
+ATOM    161  O   ASP A   9       1.771  -8.246  -0.798  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.529  -5.384  -2.684  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.629  -6.016  -3.539  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.661  -6.415  -2.960  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.415  -6.083  -4.770  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.608  -4.796  -1.483  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.451  -7.236  -2.670  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.890  -4.801  -3.319  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.960  -4.694  -1.962  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.538  -6.316   0.338  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.154  -6.771   1.590  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.656  -5.655   2.516  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.600  -5.875   3.278  1.00  0.00           O  
+ATOM    174  H   GLY A  10       1.219  -5.364   0.236  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.421  -7.360   2.140  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.998  -7.420   1.354  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.069  -4.451   2.456  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.511  -3.295   3.240  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.009  -2.997   3.049  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.473  -2.994   1.904  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.299  -4.330   1.814  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.950  -2.415   2.922  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.285  -3.490   4.287  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.798  -2.757   4.119  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.237  -2.490   4.008  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.033  -3.579   3.271  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.035  -3.275   2.626  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.745  -2.333   5.447  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.496  -1.973   6.248  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.382  -2.715   5.512  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.371  -1.546   3.479  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.173  -3.251   5.802  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.505  -1.553   5.517  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.579  -2.312   7.263  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.320  -0.898   6.189  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.273  -3.709   5.901  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.437  -2.188   5.641  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.580  -4.841   3.318  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.226  -5.980   2.655  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.995  -6.022   1.132  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.473  -6.945   0.480  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.775  -7.286   3.323  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.214  -7.315   4.671  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.719  -5.035   3.818  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.303  -5.894   2.797  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.704  -7.348   3.296  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.200  -8.143   2.797  1.00  0.00           H  
+ATOM    208  HG  SER A  13       8.172  -7.390   4.683  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.312  -5.020   0.559  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.003  -4.909  -0.880  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.153  -4.342  -1.729  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.036  -4.271  -2.950  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.797  -3.981  -1.103  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.761  -4.194  -0.169  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.943  -4.308   1.175  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.743  -5.896  -1.266  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.128  -2.964  -1.021  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.414  -4.137  -2.112  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.006  -3.709   0.659  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.240  -3.857  -1.110  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.347  -3.207  -1.825  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.072  -1.761  -2.273  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.838  -1.222  -3.067  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.290  -3.959  -0.106  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.231  -3.198  -1.187  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.588  -3.789  -2.715  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.994  -1.127  -1.781  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.572   0.231  -2.153  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.983   0.981  -0.944  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.181   0.382  -0.224  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.533   0.117  -3.285  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       6.200   1.481  -3.901  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       5.147   1.363  -5.008  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.045   2.615  -5.780  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.495   3.765  -5.404  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.939   3.937  -4.225  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.510   4.784  -6.232  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.425  -1.634  -1.117  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.445   0.765  -2.527  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.925  -0.523  -4.052  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.621  -0.343  -2.899  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.824   2.127  -3.131  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       7.111   1.904  -4.324  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.422   0.565  -5.670  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.180   1.105  -4.573  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.452   2.594  -6.699  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.987   3.199  -3.541  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.537   4.819  -3.965  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.943   4.701  -7.136  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.103   5.659  -5.956  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.298   2.279  -0.734  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.723   3.073   0.357  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.203   3.301   0.202  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.670   3.166  -0.908  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.497   4.399   0.343  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.943   4.539  -1.109  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.231   3.093  -1.505  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.912   2.560   1.300  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.863   5.216   0.629  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.374   4.317   0.985  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.164   4.960  -1.715  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.827   5.172  -1.206  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       8.069   2.954  -2.556  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.253   2.834  -1.225  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.505   3.662   1.301  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.065   3.925   1.293  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.700   5.218   0.535  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.563   6.066   0.303  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.661   4.003   2.774  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.933   4.476   3.472  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.039   3.819   2.649  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.557   3.083   0.827  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.863   4.706   2.916  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.402   3.008   3.132  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.014   5.546   3.443  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.962   4.161   4.516  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.912   4.443   2.633  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.271   2.838   3.065  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.420   5.389   0.147  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.934   6.590  -0.541  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.630   7.773   0.396  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.546   8.904  -0.075  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.347   6.136  -1.247  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.893   5.051  -0.317  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.371   4.378   0.209  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.659   6.921  -1.282  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.043   6.948  -1.342  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.093   5.696  -2.212  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.462   5.481   0.484  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.521   4.344  -0.854  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.226   4.052   1.221  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.641   3.547  -0.443  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.436   7.512   1.697  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.332   8.504   2.776  1.00  0.00           C  
+ATOM    295  C   SER A  20       1.687   8.700   3.451  1.00  0.00           C  
+ATOM    296  O   SER A  20       2.070   9.878   3.606  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -0.673   8.043   3.830  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.935   7.948   3.212  1.00  0.00           O  
+ATOM    299  OXT SER A  20       2.277   7.664   3.828  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.578   6.559   1.993  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.032   9.475   2.381  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -0.383   7.085   4.216  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -0.705   8.762   4.652  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.800   8.230   2.302  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        8                                                                  
+ATOM      1  N   ASN A   1      -8.769   4.941   0.058  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.628   3.743  -0.810  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.194   3.417  -1.223  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.825   2.255  -1.104  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.576   3.798  -2.012  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.980   3.563  -1.485  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -11.581   4.475  -0.943  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -11.465   2.335  -1.495  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.177   4.864   0.873  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.539   5.782  -0.450  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.736   5.016   0.359  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.940   2.881  -0.218  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.516   4.760  -2.484  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.322   3.021  -2.735  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.980   1.548  -1.895  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.387   2.236  -1.101  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.386   4.385  -1.677  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.979   4.182  -2.071  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.170   3.301  -1.091  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.510   2.351  -1.513  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.298   5.547  -2.330  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.562   6.652  -1.277  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.311   7.480  -1.001  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.661   7.624  -1.728  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.742   5.314  -1.830  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.973   3.640  -3.018  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.239   5.382  -2.373  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -4.613   5.914  -3.308  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.870   6.194  -0.336  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.556   6.855  -0.534  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.907   7.891  -1.928  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.544   8.302  -0.323  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -5.277   8.270  -2.519  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -6.532   7.099  -2.108  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.957   8.251  -0.887  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.272   3.566   0.214  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.591   2.791   1.257  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.035   1.316   1.320  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.216   0.439   1.587  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.809   3.489   2.607  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.680   3.265   3.592  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.635   2.094   4.373  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.676   4.243   3.732  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.601   1.916   5.312  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.650   4.078   4.679  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.618   2.916   5.478  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.344   2.765   6.428  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.793   4.381   0.493  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.522   2.805   1.039  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.904   4.544   2.433  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.748   3.153   3.047  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.397   1.337   4.260  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.691   5.139   3.130  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.558   1.031   5.929  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.099   4.851   4.791  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.794   3.595   6.593  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.312   1.025   1.029  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.855  -0.341   0.979  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.188  -1.123  -0.163  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.740  -2.254   0.031  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.398  -0.328   0.820  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.143   0.621   1.794  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.976  -1.749   0.938  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -7.792   0.462   3.281  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.901   1.775   0.693  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.609  -0.846   1.915  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.635   0.015  -0.186  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.917   1.630   1.508  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.215   0.465   1.676  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.579  -2.387   0.147  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.724  -2.190   1.903  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.062  -1.721   0.834  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.711  -0.590   3.551  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -6.848   0.965   3.496  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.578   0.918   3.885  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.075  -0.498  -1.343  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.362  -1.071  -2.489  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.867  -1.283  -2.198  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.320  -2.311  -2.590  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.555  -0.198  -3.737  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.995  -0.248  -4.266  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.126   0.517  -5.579  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.978  -0.031  -6.658  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.401   1.806  -5.540  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.445   0.441  -1.413  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.782  -2.057  -2.696  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.314   0.818  -3.488  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.891  -0.565  -4.522  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.273  -1.272  -4.428  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.680   0.175  -3.530  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.520   2.309  -4.682  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.457   2.229  -6.452  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.207  -0.362  -1.483  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.824  -0.567  -1.033  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.685  -1.753  -0.064  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.203  -2.588  -0.244  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.276   0.722  -0.418  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.118   0.612   0.126  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.254   0.594  -0.609  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.544   0.501   1.519  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.347   0.461   0.227  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.967   0.413   1.548  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.878   0.488   2.764  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.697   0.331   2.741  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.600   0.402   3.971  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.004   0.331   3.961  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.689   0.503  -1.249  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.214  -0.807  -1.905  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.281   1.482  -1.175  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.933   1.043   0.389  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.293   0.681  -1.686  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.326   0.458  -0.069  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.200   0.564   2.787  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.776   0.281   2.705  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.071   0.411   4.914  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.548   0.291   4.893  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.580  -1.874   0.927  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.599  -3.031   1.829  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.786  -4.356   1.073  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.124  -5.333   1.422  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.674  -2.852   2.916  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.324  -1.798   3.986  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.552  -1.544   4.867  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.168  -2.243   4.890  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.270  -1.136   1.054  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.625  -3.099   2.308  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.588  -2.556   2.439  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.827  -3.808   3.419  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.045  -0.863   3.506  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.374  -1.176   4.252  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.856  -2.467   5.361  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.318  -0.796   5.624  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.414  -3.187   5.378  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.257  -2.363   4.309  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.985  -1.485   5.652  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.609  -4.385   0.009  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.835  -5.565  -0.847  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.558  -6.137  -1.482  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.510  -7.335  -1.746  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.872  -5.210  -1.927  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.472  -6.419  -2.672  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -3.967  -6.562  -4.118  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -4.912  -7.488  -4.895  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -4.381  -7.814  -6.240  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.146  -3.541  -0.174  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.247  -6.357  -0.218  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.675  -4.677  -1.456  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.417  -4.531  -2.647  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.216  -7.311  -2.133  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.554  -6.284  -2.697  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -3.944  -5.597  -4.587  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -2.954  -6.968  -4.111  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.039  -8.398  -4.342  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -5.879  -6.986  -4.990  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -4.156  -6.967  -6.745  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -3.540  -8.372  -6.153  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -5.066  -8.339  -6.770  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.531  -5.310  -1.709  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.782  -5.753  -2.199  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.608  -6.478  -1.111  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.514  -7.238  -1.445  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.552  -4.536  -2.756  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.243  -4.819  -4.098  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.520  -4.894  -5.114  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.496  -4.834  -4.151  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.652  -4.327  -1.493  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.624  -6.460  -3.016  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.860  -3.728  -2.893  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.281  -4.194  -2.021  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.277  -6.270   0.176  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.025  -6.755   1.345  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.511  -5.652   2.302  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.330  -5.927   3.184  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.421  -5.751   0.355  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.382  -7.428   1.912  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.898  -7.318   1.016  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.061  -4.397   2.131  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.503  -3.261   2.946  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.031  -3.074   2.887  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.595  -3.162   1.791  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.442  -4.219   1.351  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.030  -2.351   2.579  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.173  -3.433   3.969  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.729  -2.844   4.022  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.186  -2.657   4.057  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.000  -3.804   3.440  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.098  -3.571   2.938  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.560  -2.503   5.537  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.258  -2.091   6.219  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.187  -2.773   5.373  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.428  -1.733   3.531  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.920  -3.432   5.936  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.339  -1.752   5.678  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.228  -2.441   7.233  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.143  -1.008   6.161  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.987  -3.759   5.747  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.262  -2.198   5.412  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.470  -5.035   3.441  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.162  -6.235   2.936  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.153  -6.352   1.402  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.495  -7.398   0.861  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.574  -7.490   3.595  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.813  -7.451   4.988  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.505  -5.137   3.737  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.211  -6.179   3.232  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.517  -7.526   3.415  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.054  -8.380   3.187  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.443  -6.640   5.343  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.767  -5.279   0.701  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.504  -5.245  -0.744  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.583  -4.513  -1.556  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.477  -4.434  -2.776  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.171  -4.534  -0.999  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.177  -4.877  -0.070  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.484  -4.475   1.245  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.420  -6.264  -1.123  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.334  -3.475  -0.949  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.831  -4.746  -2.011  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.259  -4.235   0.675  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.589  -3.916  -0.899  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.628  -3.120  -1.568  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.147  -1.769  -2.127  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.811  -1.210  -2.995  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.637  -4.053   0.102  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.434  -2.923  -0.862  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.042  -3.698  -2.394  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.006  -1.245  -1.647  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.372  -0.003  -2.121  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.899   0.883  -0.950  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.250   0.369  -0.033  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.209  -0.320  -3.084  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.215  -1.352  -2.526  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.904  -1.443  -3.304  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.061  -2.274  -4.499  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.904  -1.985  -5.776  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.635  -0.767  -6.189  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.003  -2.954  -6.651  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.548  -1.757  -0.908  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.120   0.548  -2.691  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.677   0.590  -3.285  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.620  -0.712  -4.017  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.685  -2.316  -2.545  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.960  -1.114  -1.497  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.151  -1.874  -2.673  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.536  -0.446  -3.542  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.127  -3.284  -4.320  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.507  -0.060  -5.490  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.473  -0.577  -7.160  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.040  -3.895  -6.271  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.899  -2.795  -7.633  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.166   2.205  -0.969  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.727   3.117   0.088  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.195   3.304   0.088  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.551   3.043  -0.934  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.460   4.433  -0.196  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.647   4.418  -1.712  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.865   2.938  -2.017  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.042   2.728   1.057  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.869   5.275   0.109  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.437   4.415   0.288  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.774   4.790  -2.212  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.499   5.023  -2.023  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.459   2.692  -2.979  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.930   2.705  -1.974  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.598   3.763   1.206  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.160   4.002   1.296  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.723   5.223   0.459  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.486   6.180   0.323  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.870   4.209   2.786  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.187   4.765   3.327  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.239   4.048   2.482  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.639   3.111   0.954  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.070   4.910   2.928  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.665   3.246   3.253  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.242   5.828   3.190  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.310   4.556   4.389  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.095   4.679   2.337  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.518   3.109   2.962  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.487   5.223  -0.081  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.954   6.306  -0.911  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.318   7.463  -0.116  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.042   8.473  -0.718  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.097   5.617  -1.786  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.667   4.552  -0.849  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.572   4.092  -0.088  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.738   6.719  -1.548  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.857   6.308  -2.094  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.396   5.133  -2.632  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.398   4.970  -0.184  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.129   3.736  -1.404  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.311   3.818   0.916  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.042   3.271  -0.628  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.154   7.315   1.206  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.381   8.320   2.134  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.429   8.296   3.426  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.669   7.163   3.906  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.858   8.039   2.425  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.535   9.236   2.730  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.789   9.398   3.882  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.527   6.490   1.654  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.263   9.307   1.688  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.309   7.588   1.562  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.945   7.348   3.266  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.973   9.971   2.469  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL        9                                                                  
+ATOM      1  N   ASN A   1      -6.355   7.914   0.576  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.778   6.858  -0.378  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -5.549   6.028  -0.782  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -4.530   6.178  -0.119  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.563   7.460  -1.562  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.448   6.400  -2.211  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.022   5.688  -3.104  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -9.658   6.188  -1.730  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.830   7.486   1.328  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.742   8.573   0.115  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.157   8.399   0.955  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.452   6.182   0.150  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.178   8.264  -1.206  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.872   7.865  -2.304  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.087   6.731  -1.001  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -10.166   5.465  -2.217  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.630   5.135  -1.783  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.587   4.213  -2.289  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.962   3.229  -1.269  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.407   2.204  -1.668  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.510   5.015  -3.058  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.772   5.277  -4.555  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.748   3.980  -5.372  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.076   6.028  -4.834  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.497   5.119  -2.318  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.078   3.561  -3.012  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.409   5.968  -2.575  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.567   4.475  -3.000  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -2.952   5.903  -4.913  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.862   3.397  -5.120  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.638   3.385  -5.182  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.712   4.225  -6.435  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -5.932   5.392  -4.613  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.123   6.933  -4.230  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.117   6.307  -5.887  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.092   3.484   0.034  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.507   2.707   1.123  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.985   1.247   1.144  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.180   0.347   1.372  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.807   3.419   2.451  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.696   3.269   3.468  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.590   2.095   4.240  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.753   4.303   3.625  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.550   1.959   5.180  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.711   4.172   4.561  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.611   3.005   5.344  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.374   2.911   6.276  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.425   4.414   0.259  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.425   2.700   0.981  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.951   4.464   2.254  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.742   3.045   2.871  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.308   1.299   4.106  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.821   5.207   3.034  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.462   1.059   5.769  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.006   4.966   4.698  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.027   2.663   7.133  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.271   0.998   0.853  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.839  -0.354   0.750  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.129  -1.160  -0.354  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.715  -2.294  -0.121  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.375  -0.317   0.526  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.137   0.556   1.557  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.940  -1.748   0.590  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.425   1.981   1.063  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.872   1.793   0.698  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.651  -0.867   1.695  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.576   0.069  -0.474  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.072   0.079   1.780  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.585   0.601   2.497  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.504  -2.371  -0.192  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.727  -2.194   1.563  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.020  -1.731   0.437  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.512   2.575   1.038  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -8.867   1.949   0.066  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.137   2.458   1.739  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.949  -0.564  -1.544  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.210  -1.179  -2.650  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.730  -1.412  -2.309  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.180  -2.447  -2.679  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.326  -0.333  -3.929  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.654  -0.555  -4.672  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.597   0.001  -6.097  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.724  -0.323  -6.881  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.527   0.846  -6.499  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.256   0.391  -1.646  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.639  -2.162  -2.849  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.251   0.704  -3.662  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.512  -0.622  -4.596  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.858  -1.608  -4.716  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.466  -0.086  -4.117  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.297   1.142  -5.929  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.409   1.126  -7.459  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.081  -0.492  -1.584  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.717  -0.712  -1.094  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.634  -1.871  -0.083  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.235  -2.738  -0.203  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.168   0.595  -0.511  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.222   0.490   0.032  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.356   0.444  -0.705  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.648   0.375   1.425  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.446   0.307   0.129  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.068   0.266   1.450  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.980   0.360   2.668  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.796   0.163   2.643  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.699   0.248   3.874  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.103   0.153   3.864  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.567   0.373  -1.361  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.089  -0.993  -1.940  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.171   1.336  -1.287  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.824   0.933   0.292  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.407   0.492  -1.782  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.421   0.258  -0.183  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.097   0.448   2.689  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.873   0.086   2.605  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.170   0.248   4.818  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.648   0.079   4.793  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.559  -1.927   0.884  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.650  -3.030   1.843  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.902  -4.384   1.166  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.269  -5.361   1.560  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.733  -2.741   2.896  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.320  -1.710   3.964  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.516  -1.453   4.886  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.139  -2.196   4.813  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.231  -1.165   0.952  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.687  -3.126   2.344  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.603  -2.370   2.390  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.981  -3.673   3.405  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.041  -0.773   3.487  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.353  -1.069   4.302  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.815  -2.379   5.378  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.251  -0.717   5.645  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.303  -3.225   5.133  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.219  -2.141   4.234  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.022  -1.564   5.694  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.764  -4.435   0.137  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.064  -5.639  -0.660  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.824  -6.358  -1.202  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.858  -7.580  -1.310  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.983  -5.265  -1.837  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.484  -5.361  -1.533  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.970  -6.821  -1.519  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.373  -6.934  -2.133  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.546  -8.214  -2.860  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.276  -3.581  -0.075  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.567  -6.365  -0.022  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.764  -4.255  -2.124  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.765  -5.907  -2.694  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.673  -4.922  -0.572  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.001  -4.816  -2.323  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.288  -7.424  -2.086  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.982  -7.196  -0.493  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -8.103  -6.877  -1.348  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.516  -6.106  -2.833  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -6.850  -8.287  -3.593  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.431  -8.996  -2.230  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.463  -8.259  -3.283  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.763  -5.623  -1.552  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.496  -6.197  -2.043  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.282  -6.902  -0.920  1.00  0.00           C  
+ATOM    161  O   ASP A   9       1.817  -7.991  -1.121  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.321  -5.072  -2.691  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.292  -5.605  -3.748  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.441  -5.927  -3.382  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.868  -5.659  -4.923  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.837  -4.618  -1.476  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.265  -6.940  -2.810  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.651  -4.376  -3.157  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.866  -4.522  -1.921  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.295  -6.304   0.280  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.040  -6.794   1.445  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.489  -5.723   2.455  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.314  -6.013   3.317  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.707  -5.487   0.357  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.418  -7.514   1.975  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.937  -7.314   1.102  1.00  0.00           H  
+ATOM    177  N   GLY A  11       1.982  -4.483   2.376  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.428  -3.400   3.257  1.00  0.00           C  
+ATOM    179  C   GLY A  11       3.939  -3.116   3.122  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.431  -3.017   1.996  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.270  -4.287   1.690  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.885  -2.490   3.006  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.184  -3.679   4.281  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.698  -2.946   4.226  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.130  -2.631   4.172  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.010  -3.666   3.454  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.063  -3.297   2.936  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.588  -2.475   5.628  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.303  -2.191   6.399  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.243  -2.957   5.611  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.248  -1.673   3.664  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.051  -3.377   5.980  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.305  -1.661   5.732  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.371  -2.555   7.406  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.086  -1.123   6.366  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.164  -3.965   5.971  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.275  -2.469   5.727  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.616  -4.948   3.398  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.425  -6.010   2.779  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.282  -6.083   1.247  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.825  -6.993   0.624  1.00  0.00           O  
+ATOM    202  CB  SER A  13       7.160  -7.358   3.464  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.803  -7.725   3.370  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.705  -5.222   3.755  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.474  -5.782   2.964  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       7.759  -8.113   2.992  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.430  -7.277   4.519  1.00  0.00           H  
+ATOM    208  HG  SER A  13       5.735  -8.681   3.298  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.606  -5.101   0.635  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.348  -4.975  -0.808  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.404  -4.162  -1.577  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.289  -3.990  -2.790  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.008  -4.262  -1.007  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.002  -4.863  -0.226  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.121  -4.441   1.233  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.278  -5.969  -1.254  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.110  -3.234  -0.719  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.727  -4.291  -2.059  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.353  -4.187  -0.015  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.395  -3.574  -0.897  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.449  -2.750  -1.509  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.021  -1.317  -1.874  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.808  -0.389  -1.697  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.410  -3.718   0.104  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.294  -2.689  -0.823  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.796  -3.237  -2.420  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.790  -1.115  -2.367  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.218   0.212  -2.656  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.821   0.946  -1.353  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.154   0.335  -0.515  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.002   0.046  -3.589  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.399   1.393  -4.024  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.125   1.223  -4.857  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.497   2.535  -5.114  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       2.320   2.983  -4.685  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       1.482   2.226  -4.014  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       1.953   4.216  -4.940  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.238  -1.952  -2.530  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       7.984   0.787  -3.176  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.312  -0.490  -4.465  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.238  -0.540  -3.076  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.163   1.964  -3.147  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.135   1.947  -4.608  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.374   0.761  -5.793  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.445   0.561  -4.322  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.053   3.192  -5.635  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       1.728   1.264  -3.884  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       0.601   2.578  -3.692  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       2.560   4.835  -5.449  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       1.060   4.549  -4.627  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.132   2.251  -1.190  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.721   3.035  -0.016  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.194   3.259   0.062  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.507   3.162  -0.959  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.473   4.368  -0.143  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.674   4.523  -1.648  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.904   3.085  -2.103  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.053   2.520   0.885  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.889   5.177   0.251  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.446   4.287   0.346  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.803   4.942  -2.114  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.524   5.165  -1.882  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.561   2.953  -3.111  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.962   2.836  -2.011  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.651   3.589   1.252  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.222   3.833   1.437  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.772   5.142   0.759  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.480   6.148   0.843  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.004   3.890   2.953  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.356   4.348   3.494  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.355   3.724   2.520  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.669   2.988   1.034  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.233   4.593   3.203  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.784   2.892   3.327  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.430   5.418   3.487  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.520   4.003   4.516  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.211   4.361   2.405  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.649   2.736   2.877  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.591   5.165   0.108  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.031   6.371  -0.488  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.380   7.262   0.584  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.321   6.767   1.470  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.009   5.859  -1.504  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.512   4.571  -0.862  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.696   4.034  -0.095  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.809   6.936  -1.005  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.784   6.568  -1.642  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.521   5.617  -2.437  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.327   4.778  -0.196  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.847   3.854  -1.611  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.386   3.632   0.850  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.206   3.279  -0.693  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.592   8.578   0.472  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.019   9.620   1.329  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.235  10.875   0.498  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.745  11.327  -0.137  1.00  0.00           O  
+ATOM    297  CB  SER A  20       0.977   9.898   2.490  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.308  10.641   3.489  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.409  11.298   0.440  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.168   8.935  -0.278  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.939   9.293   1.731  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.316   8.968   2.904  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.845  10.449   2.120  1.00  0.00           H  
+ATOM    304  HG  SER A  20       0.955  10.989   4.106  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       10                                                                  
+ATOM      1  N   ASN A   1      -6.943   6.963   0.951  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.689   6.240  -0.107  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.888   5.124  -0.770  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.377   4.006  -0.773  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.340   7.202  -1.116  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.413   8.048  -0.430  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.573   7.981   0.781  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.146   8.872  -1.153  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.551   6.315   1.619  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.210   7.532   0.552  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.600   7.571   1.435  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.514   5.723   0.389  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.587   7.849  -1.524  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.816   6.622  -1.909  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.039   8.989  -2.148  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -10.843   9.380  -0.632  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.683   5.360  -1.308  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.939   4.305  -2.022  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.268   3.260  -1.097  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.716   2.270  -1.573  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.943   4.985  -2.983  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.510   4.134  -4.197  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.689   3.815  -5.127  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.467   4.910  -5.004  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.289   6.289  -1.343  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.665   3.756  -2.620  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.400   5.882  -3.353  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.059   5.272  -2.417  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.055   3.203  -3.864  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.375   3.120  -4.648  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -5.221   4.730  -5.390  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.321   3.345  -6.040  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.887   5.852  -5.359  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.596   5.115  -4.384  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -2.147   4.317  -5.861  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.340   3.443   0.228  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.683   2.595   1.228  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.096   1.115   1.160  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.266   0.248   1.427  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.925   3.179   2.630  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.760   2.970   3.580  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.680   3.874   3.561  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -2.753   1.884   4.475  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.588   3.691   4.430  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -1.662   1.698   5.348  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.577   2.599   5.325  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.476   2.408   6.162  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.813   4.268   0.548  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.609   2.637   1.035  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.100   4.233   2.534  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.832   2.746   3.057  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.686   4.718   2.886  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -3.582   1.193   4.494  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.229   4.396   4.422  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -1.639   0.873   6.042  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.215   2.981   5.950  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.333   0.810   0.732  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.790  -0.565   0.464  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -4.909  -1.223  -0.610  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.439  -2.342  -0.417  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.285  -0.604   0.049  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.234   0.069   1.074  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.764  -2.056  -0.139  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.662   1.477   0.657  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.959   1.576   0.529  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.679  -1.148   1.381  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.388  -0.102  -0.916  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.112  -0.539   1.177  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.760   0.113   2.055  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.127  -2.599  -0.836  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.772  -2.577   0.819  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.776  -2.054  -0.550  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.813   2.149   0.745  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.034   1.472  -0.368  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.458   1.827   1.316  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.664  -0.521  -1.727  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -3.843  -0.981  -2.852  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.374  -1.203  -2.455  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -1.735  -2.102  -2.996  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -3.966   0.016  -4.026  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.731  -0.540  -5.248  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -3.839  -0.991  -6.408  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -2.801  -0.426  -6.704  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.226  -2.006  -7.158  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -4.986   0.437  -1.755  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.229  -1.945  -3.174  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.481   0.889  -3.674  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -2.974   0.357  -4.328  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.311  -1.383  -4.925  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.374   0.252  -5.631  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -5.133  -2.431  -7.060  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.683  -2.060  -8.004  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.859  -0.430  -1.488  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.534  -0.641  -0.897  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.505  -1.815   0.100  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.412  -2.635   0.060  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.068   0.666  -0.245  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.303   0.611   0.356  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.468   0.703  -0.325  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.674   0.434   1.758  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.528   0.564   0.550  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.097   0.425   1.849  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.953   0.284   2.960  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.775   0.299   3.069  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.622   0.134   4.190  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.026   0.159   4.250  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.448   0.312  -1.131  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.169  -0.885  -1.694  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.074   1.434  -0.994  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.776   0.954   0.532  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.556   0.855  -1.394  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.512   0.575   0.270  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.126   0.291   2.931  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.854   0.309   3.090  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.050   0.016   5.100  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.527   0.067   5.203  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.510  -1.935   0.978  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.599  -3.048   1.926  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.809  -4.403   1.239  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.124  -5.355   1.613  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.699  -2.798   2.974  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.286  -1.852   4.119  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.491  -1.640   5.038  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.140  -2.415   4.972  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.224  -1.210   1.007  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.640  -3.131   2.434  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.547  -2.370   2.475  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.977  -3.755   3.419  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.983  -0.891   3.707  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.312  -1.199   4.473  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.814  -2.592   5.458  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.224  -0.969   5.855  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.389  -3.418   5.318  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.217  -2.452   4.397  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.968  -1.773   5.834  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.697  -4.510   0.235  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.957  -5.783  -0.469  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.729  -6.374  -1.170  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.710  -7.566  -1.460  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.168  -5.663  -1.419  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.006  -4.746  -2.644  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -3.193  -5.323  -3.812  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -3.386  -4.457  -5.061  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -2.231  -4.566  -5.977  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.247  -3.686  -0.007  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.228  -6.519   0.290  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.396  -6.648  -1.779  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -5.007  -5.283  -0.833  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.987  -4.511  -3.011  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -3.534  -3.825  -2.321  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -2.153  -5.339  -3.548  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -3.497  -6.350  -4.023  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -4.271  -4.779  -5.575  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -3.483  -3.417  -4.746  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -1.362  -4.377  -5.451  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -2.123  -5.504  -6.333  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -2.292  -3.898  -6.731  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.707  -5.552  -1.426  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.589  -5.960  -1.966  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.516  -6.588  -0.906  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.485  -7.250  -1.274  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.253  -4.722  -2.594  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.159  -4.718  -4.115  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.038  -4.607  -4.656  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.240  -4.782  -4.738  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.829  -4.576  -1.196  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.438  -6.713  -2.742  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.768  -3.843  -2.217  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.307  -4.701  -2.323  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.212  -6.406   0.389  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.037  -6.837   1.523  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.524  -5.698   2.431  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.335  -5.946   3.326  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.334  -5.944   0.606  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.452  -7.525   2.133  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.916  -7.372   1.161  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.079  -4.450   2.212  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.527  -3.280   2.968  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.060  -3.125   2.939  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.630  -3.169   1.842  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.473  -4.294   1.414  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.088  -2.385   2.527  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.161  -3.373   3.989  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.753  -2.971   4.089  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.211  -2.791   4.140  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.014  -3.874   3.403  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.041  -3.574   2.797  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.582  -2.768   5.628  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.287  -2.370   6.329  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.205  -2.974   5.438  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.452  -1.822   3.699  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.909  -3.736   5.954  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.381  -2.053   5.830  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.244  -2.782   7.319  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.193  -1.282   6.336  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.982  -3.977   5.748  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.295  -2.381   5.511  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.533  -5.123   3.409  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.187  -6.275   2.772  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.064  -6.297   1.237  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.472  -7.272   0.612  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.637  -7.571   3.386  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.985  -7.634   4.757  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.655  -5.302   3.884  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.253  -6.230   2.991  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.569  -7.587   3.288  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.058  -8.437   2.875  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.938  -7.738   4.830  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.524  -5.234   0.624  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.244  -5.155  -0.818  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.352  -4.486  -1.642  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.292  -4.512  -2.869  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.956  -4.361  -1.069  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.953  -4.634  -0.126  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.200  -4.481   1.217  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.093  -6.164  -1.206  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.186  -3.314  -1.030  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.589  -4.586  -2.070  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.150  -4.078   0.666  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.336  -3.840  -0.998  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.395  -3.094  -1.693  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.943  -1.756  -2.301  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.512  -1.327  -3.303  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.352  -3.897   0.012  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.206  -2.893  -0.996  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.795  -3.712  -2.500  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.916  -1.105  -1.732  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.364   0.181  -2.198  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.867   1.046  -1.024  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.262   0.497  -0.098  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.251  -0.057  -3.241  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.161  -1.058  -2.811  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.134  -1.346  -3.924  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.103  -2.766  -4.336  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.054  -3.492  -4.909  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.220  -2.996  -5.246  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.821  -4.753  -5.163  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.511  -1.511  -0.898  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.172   0.718  -2.695  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.778   0.884  -3.444  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.725  -0.430  -4.149  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.634  -1.981  -2.535  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.637  -0.670  -1.938  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.159  -1.073  -3.568  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.340  -0.723  -4.795  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.238  -3.299  -4.232  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       6.407  -2.037  -5.038  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       6.943  -3.615  -5.560  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       3.839  -5.043  -5.009  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       5.505  -5.381  -5.529  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.083   2.378  -1.045  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.638   3.277   0.023  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.104   3.442   0.035  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.455   3.170  -0.978  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.343   4.610  -0.260  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.496   4.611  -1.779  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.741   3.138  -2.101  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.968   2.888   0.986  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.744   5.438   0.067  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.332   4.604   0.204  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.603   4.967  -2.256  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.328   5.240  -2.103  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.319   2.890  -3.056  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.812   2.932  -2.083  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.512   3.890   1.161  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.074   4.111   1.260  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.616   5.335   0.440  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.395   6.265   0.230  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.796   4.301   2.754  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.105   4.879   3.287  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.162   4.183   2.431  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.556   3.220   0.910  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.983   4.984   2.910  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.610   3.329   3.214  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.140   5.943   3.153  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.240   4.666   4.348  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.005   4.829   2.279  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.463   3.249   2.906  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.341   5.370   0.004  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.777   6.481  -0.754  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.447   7.673   0.157  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.482   7.605   0.965  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.466   5.904  -1.437  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.933   4.811  -0.475  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.371   4.292   0.127  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.481   6.804  -1.523  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.221   6.657  -1.557  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.172   5.448  -2.384  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.573   5.216   0.285  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.468   4.019  -0.996  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.227   4.038   1.160  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.725   3.441  -0.450  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.209   8.762   0.004  1.00  0.00           N  
+ATOM    294  CA  SER A  20       1.059  10.038   0.716  1.00  0.00           C  
+ATOM    295  C   SER A  20       1.217  11.216  -0.248  1.00  0.00           C  
+ATOM    296  O   SER A  20       2.389  11.403  -0.664  1.00  0.00           O  
+ATOM    297  CB  SER A  20       2.098  10.115   1.845  1.00  0.00           C  
+ATOM    298  OG  SER A  20       3.359  10.263   1.230  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.202  11.886  -0.520  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.991   8.709  -0.634  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.060  10.107   1.146  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.894  10.958   2.477  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.070   9.211   2.456  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.120  10.769   0.374  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       11                                                                  
+ATOM      1  N   ASN A   1      -6.688   7.436  -0.473  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.529   6.238  -0.712  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.749   5.006  -1.210  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.279   3.906  -1.158  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.713   6.573  -1.639  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.880   5.632  -1.366  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.413   5.629  -0.269  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.300   4.816  -2.315  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.936   7.221   0.168  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.305   7.780  -1.344  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.252   8.169  -0.065  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.963   5.944   0.246  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.025   7.584  -1.463  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.412   6.523  -2.686  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.869   4.743  -3.220  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.067   4.224  -2.039  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.494   5.147  -1.665  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.691   4.051  -2.237  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.046   3.125  -1.181  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.429   2.120  -1.531  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.615   4.692  -3.131  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.196   5.327  -4.413  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.432   6.605  -4.768  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.134   4.351  -5.589  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.038   6.044  -1.695  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.328   3.419  -2.859  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.113   5.455  -2.568  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.872   3.942  -3.409  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.238   5.607  -4.254  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.529   7.331  -3.961  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.377   6.382  -4.926  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.850   7.041  -5.676  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.107   4.029  -5.760  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.756   3.481  -5.378  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.508   4.834  -6.491  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.195   3.445   0.111  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.594   2.700   1.221  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.029   1.227   1.239  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.224   0.352   1.545  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.934   3.395   2.550  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.766   3.426   3.514  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.442   2.278   4.260  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.987   4.594   3.643  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.344   2.291   5.138  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.891   4.614   4.527  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.566   3.461   5.272  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.481   3.472   6.138  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.719   4.274   0.329  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.512   2.721   1.090  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.233   4.404   2.342  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.777   2.889   3.026  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.039   1.385   4.148  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.219   5.478   3.065  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.086   1.416   5.715  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.292   5.509   4.627  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.250   3.913   6.958  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.286   0.955   0.858  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.847  -0.393   0.739  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.076  -1.179  -0.327  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.596  -2.269  -0.040  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.361  -0.341   0.420  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.160   0.545   1.415  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.962  -1.760   0.413  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.201   1.423   0.710  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.875   1.740   0.624  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.714  -0.910   1.692  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.471   0.071  -0.583  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.664  -0.092   2.116  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.498   1.210   1.968  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.462  -2.390  -0.323  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.853  -2.219   1.398  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.022  -1.713   0.159  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.755   1.914  -0.157  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.046   0.816   0.386  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.552   2.192   1.399  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.908  -0.611  -1.532  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.116  -1.188  -2.627  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.676  -1.485  -2.194  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.183  -2.586  -2.432  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.133  -0.239  -3.843  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.217  -0.612  -4.859  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.369   0.472  -5.923  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.272   1.289  -5.876  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.484   0.535  -6.899  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.264   0.324  -1.655  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.559  -2.141  -2.917  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.314   0.761  -3.498  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.168  -0.273  -4.350  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.948  -1.535  -5.335  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.173  -0.735  -4.347  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.716  -0.109  -6.984  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -4.657   1.272  -7.562  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.015  -0.526  -1.535  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.661  -0.714  -1.009  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.581  -1.833   0.042  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.287  -2.706  -0.046  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.147   0.614  -0.453  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.240   0.540   0.100  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.369   0.426  -0.635  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.668   0.524   1.498  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.457   0.329   0.207  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.087   0.401   1.528  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.008   0.607   2.744  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.824   0.375   2.719  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.737   0.578   3.950  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.140   0.468   3.941  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.482   0.369  -1.404  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.009  -1.011  -1.832  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.158   1.339  -1.244  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.819   0.959   0.333  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.409   0.399  -1.716  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.432   0.245  -0.091  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.065   0.714   2.764  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.901   0.285   2.682  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.222   0.668   4.895  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.687   0.462   4.872  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.500  -1.852   1.018  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.566  -2.933   2.003  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.887  -4.289   1.365  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.341  -5.295   1.810  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.578  -2.606   3.117  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.079  -1.558   4.127  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.224  -1.188   5.075  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.891  -2.038   4.980  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.182  -1.096   1.068  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.574  -3.041   2.436  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.475  -2.234   2.660  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.812  -3.520   3.665  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.776  -0.664   3.583  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.066  -0.795   4.505  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.553  -2.070   5.626  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.889  -0.433   5.787  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.235  -2.453   5.927  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.314  -2.808   4.473  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.234  -1.196   5.184  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.711  -4.325   0.308  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.090  -5.545  -0.417  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.889  -6.299  -0.992  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.885  -7.526  -0.985  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.077  -5.189  -1.537  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.961  -6.377  -1.915  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.092  -5.927  -2.853  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.345  -6.989  -3.925  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.706  -6.871  -4.496  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.163  -3.451   0.044  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.576  -6.217   0.293  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.702  -4.383  -1.205  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.527  -4.857  -2.421  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.364  -7.118  -2.411  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.410  -6.796  -1.012  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.988  -5.780  -2.282  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.831  -4.988  -3.347  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.625  -6.869  -4.712  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.210  -7.979  -3.483  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.393  -7.094  -3.788  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.869  -5.930  -4.825  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.818  -7.515  -5.269  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.879  -5.565  -1.461  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.388  -6.124  -1.938  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.241  -6.707  -0.792  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.087  -7.564  -1.026  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.146  -5.019  -2.691  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.006  -5.586  -3.819  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.181  -5.908  -3.534  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.487  -5.664  -4.954  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.992  -4.558  -1.468  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.170  -6.935  -2.635  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.435  -4.333  -3.108  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.772  -4.458  -1.992  1.00  0.00           H  
+ATOM    170  N   GLY A  10       0.985  -6.274   0.450  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.737  -6.639   1.646  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.495  -5.468   2.278  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.461  -5.715   3.003  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.165  -5.692   0.580  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.039  -7.025   2.389  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.442  -7.433   1.411  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.110  -4.213   1.995  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.673  -3.013   2.615  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.207  -2.948   2.501  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.725  -3.042   1.386  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.398  -4.072   1.288  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.258  -2.139   2.116  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.357  -2.986   3.655  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.960  -2.809   3.616  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.424  -2.779   3.578  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.069  -4.028   2.960  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.189  -3.932   2.461  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.890  -2.607   5.031  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.663  -2.077   5.767  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.496  -2.685   4.991  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.736  -1.908   3.002  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.202  -3.547   5.443  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.726  -1.910   5.099  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.657  -2.404   6.789  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.630  -0.990   5.687  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.243  -3.649   5.389  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.623  -2.038   5.075  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.387  -5.186   2.959  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.949  -6.443   2.439  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.314  -6.364   0.949  1.00  0.00           C  
+ATOM    201  O   SER A  13       8.295  -6.974   0.530  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.004  -7.621   2.705  1.00  0.00           C  
+ATOM    203  OG  SER A  13       4.930  -7.624   1.798  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.432  -5.191   3.307  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.871  -6.641   2.985  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.551  -8.539   2.604  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.606  -7.556   3.718  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.348  -6.883   2.036  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.579  -5.561   0.169  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.820  -5.327  -1.256  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.922  -4.294  -1.522  1.00  0.00           C  
+ATOM    212  O   SER A  14       8.242  -4.017  -2.677  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.537  -4.831  -1.928  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.441  -5.626  -1.548  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.746  -5.132   0.560  1.00  0.00           H  
+ATOM    216  HA  SER A  14       7.104  -6.271  -1.725  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.355  -3.815  -1.634  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.656  -4.884  -3.011  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.881  -5.799  -2.406  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.461  -3.653  -0.477  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.520  -2.646  -0.549  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.063  -1.246  -0.987  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.688  -0.260  -0.601  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.144  -3.918   0.453  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.982  -2.562   0.434  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.282  -2.988  -1.252  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.983  -1.136  -1.775  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.407   0.144  -2.217  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.873   0.959  -1.017  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.188   0.381  -0.171  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.295  -0.134  -3.247  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.773   1.159  -3.895  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.638   0.926  -4.896  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.119   0.301  -6.142  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.470   0.248  -7.298  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.270   0.763  -7.440  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.020  -0.326  -8.342  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.569  -2.007  -2.081  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.207   0.703  -2.701  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.686  -0.773  -4.015  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.468  -0.652  -2.755  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.414   1.807  -3.119  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.591   1.664  -4.410  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.906   0.283  -4.446  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.201   1.899  -5.127  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       6.032  -0.122  -6.114  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.845   1.192  -6.637  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.779   0.716  -8.314  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.933  -0.740  -8.273  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.520  -0.368  -9.211  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.105   2.288  -0.945  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.592   3.134   0.139  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.058   3.310   0.093  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.451   3.102  -0.962  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.309   4.480  -0.034  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.588   4.545  -1.531  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.889   3.089  -1.878  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.871   2.694   1.095  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.679   5.292   0.274  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.253   4.460   0.511  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.731   4.902  -2.069  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.431   5.198  -1.763  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.597   2.878  -2.889  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.949   2.883  -1.728  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.425   3.724   1.211  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       2.983   3.945   1.275  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.554   5.198   0.492  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.293   6.183   0.449  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.654   4.089   2.764  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.948   4.624   3.370  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.036   3.983   2.507  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.476   3.068   0.878  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.847   4.781   2.913  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.438   3.109   3.186  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.988   5.694   3.306  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.049   4.343   4.419  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.868   4.652   2.399  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.351   3.039   2.955  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.342   5.203  -0.093  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.805   6.357  -0.803  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.320   7.423   0.190  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.257   7.100   1.229  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.339   5.795  -1.648  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.864   4.631  -0.807  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.380   4.112  -0.089  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.566   6.787  -1.457  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.102   6.533  -1.800  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.063   5.409  -2.586  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.599   4.969  -0.102  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.304   3.856  -1.430  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.138   3.834   0.919  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.800   3.273  -0.642  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.540   8.696  -0.154  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.107   9.883   0.597  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.517  10.892  -0.359  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.173  11.221  -1.351  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.287  10.518   1.338  1.00  0.00           C  
+ATOM    298  OG  SER A  20       1.823   9.586   2.254  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.676  11.275  -0.100  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.976   8.906  -1.042  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.660   9.612   1.323  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.043  10.801   0.631  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.947  11.404   1.878  1.00  0.00           H  
+ATOM    304  HG  SER A  20       1.894   8.744   1.792  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       12                                                                  
+ATOM      1  N   ASN A   1      -4.775   8.349   0.978  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -5.666   7.501   0.145  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -4.883   6.315  -0.422  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -3.710   6.189  -0.099  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.368   8.312  -0.963  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.731   7.695  -1.245  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.561   7.621  -0.357  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.984   7.161  -2.427  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -4.291   7.782   1.665  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -4.059   8.774   0.407  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -5.305   9.067   1.452  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.445   7.096   0.797  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -6.493   9.328  -0.640  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -5.758   8.337  -1.869  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.370   7.224  -3.224  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.930   6.818  -2.517  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.505   5.439  -1.230  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.870   4.301  -1.933  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.253   3.217  -1.013  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.725   2.212  -1.488  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.879   4.858  -2.987  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.862   4.103  -4.338  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.942   5.102  -5.500  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.594   3.266  -4.529  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.484   5.595  -1.443  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.671   3.797  -2.474  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.141   5.880  -3.181  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.875   4.881  -2.566  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.728   3.445  -4.407  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.863   5.680  -5.430  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.088   5.780  -5.472  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.942   4.567  -6.450  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.714   3.909  -4.532  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -2.501   2.537  -3.726  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -2.650   2.733  -5.479  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.358   3.387   0.311  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.724   2.561   1.334  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.131   1.084   1.243  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.272   0.213   1.349  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -4.034   3.171   2.713  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -3.135   2.703   3.842  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.737   2.851   3.727  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -3.685   2.171   5.024  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.891   2.412   4.759  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -2.842   1.741   6.067  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -1.438   1.829   5.920  1.00  0.00           C  
+ATOM     47  OH  TYR A   3      -0.611   1.332   6.879  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.748   4.266   0.609  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.648   2.608   1.169  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.940   4.237   2.633  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -5.076   2.964   2.965  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.301   3.304   2.848  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -4.757   2.089   5.139  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.181   2.515   4.674  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -3.268   1.331   6.971  1.00  0.00           H  
+ATOM     56  HH  TYR A   3      -1.077   0.804   7.527  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.411   0.798   0.958  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.929  -0.561   0.735  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.151  -1.265  -0.392  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.770  -2.424  -0.234  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.448  -0.558   0.412  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.318   0.310   1.355  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.010  -2.000   0.433  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.502   1.763   0.894  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -6.043   1.576   0.880  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.774  -1.132   1.651  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.573  -0.182  -0.605  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.288  -0.144   1.429  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.900   0.296   2.364  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.241  -2.738   0.216  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -8.427  -2.236   1.414  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.799  -2.084  -0.315  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.575   2.327   0.979  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -8.846   1.782  -0.141  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.256   2.242   1.519  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.901  -0.573  -1.513  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.125  -1.106  -2.634  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.693  -1.437  -2.204  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.251  -2.565  -2.402  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.128  -0.128  -3.830  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.010  -0.590  -5.001  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.334  -0.299  -6.339  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.559   0.724  -6.965  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.468  -1.181  -6.803  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.142   0.409  -1.535  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.578  -2.049  -2.940  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.488   0.824  -3.489  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.103  -0.020  -4.191  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.182  -1.646  -4.916  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.966  -0.069  -4.961  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.220  -2.017  -6.300  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.046  -0.932  -7.681  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.990  -0.483  -1.580  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.617  -0.690  -1.102  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.505  -1.806  -0.047  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.434  -2.605  -0.072  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.075   0.634  -0.556  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.309   0.540   0.003  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.446   0.522  -0.728  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.725   0.405   1.396  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.531   0.366   0.112  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.148   0.312   1.431  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.050   0.354   2.636  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.871   0.207   2.626  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.766   0.241   3.845  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.172   0.180   3.843  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.436   0.418  -1.445  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.001  -0.996  -1.948  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.069   1.351  -1.354  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.741   0.996   0.231  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.490   0.606  -1.806  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.506   0.317  -0.195  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.028   0.413   2.652  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.948   0.144   2.596  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.233   0.211   4.786  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.712   0.109   4.775  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.478  -1.903   0.868  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.565  -3.023   1.803  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.788  -4.359   1.077  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.184  -5.351   1.478  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.659  -2.772   2.854  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.323  -1.690   3.899  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.521  -1.550   4.842  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.085  -2.027   4.739  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.200  -1.184   0.892  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.606  -3.120   2.310  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.552  -2.472   2.340  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.840  -3.707   3.385  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.150  -0.733   3.410  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.397  -1.228   4.278  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.729  -2.502   5.330  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.305  -0.807   5.605  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.199  -3.007   5.202  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.194  -2.019   4.114  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.952  -1.273   5.515  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.578  -4.390  -0.010  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.803  -5.590  -0.835  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.523  -6.177  -1.436  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.444  -7.395  -1.565  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.841  -5.306  -1.943  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.102  -6.183  -1.820  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.388  -5.360  -1.964  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.575  -6.172  -1.439  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.803  -5.348  -1.365  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.058  -3.531  -0.269  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.176  -6.367  -0.170  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.133  -4.275  -1.883  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.394  -5.473  -2.925  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.081  -6.931  -2.589  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.122  -6.674  -0.847  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.297  -4.453  -1.399  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.539  -5.092  -3.010  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.750  -7.001  -2.098  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.320  -6.540  -0.441  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.641  -4.541  -0.776  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -9.066  -5.030  -2.289  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.564  -5.888  -0.973  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.517  -5.351  -1.751  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.810  -5.841  -2.151  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.554  -6.575  -1.011  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.438  -7.380  -1.298  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.696  -4.676  -2.632  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.245  -3.986  -3.921  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.597  -4.502  -5.006  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.666  -2.883  -3.811  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.685  -4.351  -1.702  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.696  -6.548  -2.974  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.720  -3.937  -1.854  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.698  -5.068  -2.815  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.225  -6.295   0.263  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.982  -6.737   1.446  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.507  -5.606   2.352  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.317  -5.867   3.245  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.375  -5.762   0.424  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.336  -7.376   2.049  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.840  -7.334   1.133  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.078  -4.353   2.136  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.489  -3.194   2.933  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.018  -3.015   3.017  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.676  -2.975   1.975  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.434  -4.188   1.373  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.070  -2.296   2.478  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.056  -3.301   3.926  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.624  -2.897   4.222  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.074  -2.717   4.372  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.928  -3.824   3.735  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.086  -3.582   3.404  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.342  -2.659   5.880  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       4.997  -2.271   6.487  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       3.985  -2.895   5.530  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.352  -1.763   3.924  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.663  -3.615   6.246  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.115  -1.929   6.121  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       4.891  -2.675   7.475  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       4.893  -1.186   6.477  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.753  -3.898   5.834  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.065  -2.308   5.536  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.371  -5.030   3.550  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.084  -6.170   2.958  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.083  -6.156   1.418  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.625  -7.072   0.804  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.515  -7.484   3.508  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.707  -7.539   4.910  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.380  -5.139   3.743  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.130  -6.125   3.264  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.466  -7.537   3.290  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.033  -8.329   3.054  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.297  -6.766   5.305  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.505  -5.124   0.784  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.326  -5.021  -0.674  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.445  -4.276  -1.413  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.363  -4.116  -2.632  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.029  -4.263  -0.971  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.953  -4.822  -0.267  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.012  -4.435   1.345  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.241  -6.022  -1.098  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.146  -3.237  -0.678  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.818  -4.312  -2.040  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.220  -4.203  -0.295  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.438  -3.724  -0.707  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.507  -2.889  -1.274  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.063  -1.480  -1.708  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.798  -0.518  -1.489  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.430  -3.884   0.291  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.304  -2.784  -0.538  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.927  -3.393  -2.147  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.872  -1.340  -2.309  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.271  -0.051  -2.694  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.858   0.790  -1.462  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.260   0.241  -0.533  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.089  -0.273  -3.662  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       4.953  -1.164  -3.120  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.733  -1.249  -4.050  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.008  -2.020  -5.278  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.304  -1.553  -6.487  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       4.332  -0.266  -6.751  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.584  -2.382  -7.463  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.380  -2.207  -2.502  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.042   0.496  -3.233  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.672   0.686  -3.902  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.479  -0.726  -4.575  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.339  -2.155  -2.977  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.607  -0.763  -2.173  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       2.929  -1.722  -3.520  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.380  -0.245  -4.284  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.860  -3.017  -5.208  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.070   0.367  -6.019  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       4.528   0.072  -7.675  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.555  -3.374  -7.290  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.810  -2.036  -8.376  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.111   2.116  -1.447  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.730   2.992  -0.332  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.203   3.215  -0.255  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.512   3.033  -1.262  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.472   4.309  -0.592  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.586   4.354  -2.114  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.780   2.885  -2.487  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.081   2.557   0.604  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.910   5.146  -0.224  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.471   4.256  -0.155  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.692   4.750  -2.556  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.426   4.969  -2.440  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.339   2.682  -3.444  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.845   2.645  -2.487  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.666   3.621   0.914  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.235   3.860   1.094  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.748   5.165   0.425  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.529   6.100   0.248  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.024   3.899   2.612  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.361   4.406   3.146  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.372   3.796   2.177  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.688   3.015   0.682  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.228   4.570   2.871  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.846   2.890   2.983  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.404   5.478   3.124  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.538   4.078   4.171  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.209   4.455   2.048  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.693   2.821   2.549  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.443   5.263   0.091  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.813   6.446  -0.514  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.366   7.514   0.505  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.168   8.563   0.135  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.418   5.883  -1.228  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.852   4.754  -0.291  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.481   4.171   0.160  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.483   6.910  -1.240  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.186   6.626  -1.322  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.127   5.468  -2.194  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.411   5.134   0.542  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.463   4.012  -0.801  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.406   3.804   1.165  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.786   3.388  -0.533  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.475   7.235   1.804  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.117   8.121   2.917  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.951   7.740   4.134  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.145   6.518   4.316  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.376   8.004   3.229  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.078   8.526   2.113  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.384   8.682   4.830  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.881   6.355   2.097  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.361   9.155   2.677  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.640   6.975   3.382  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.610   8.576   4.131  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.383   8.683   1.436  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       13                                                                  
+ATOM      1  N   ASN A   1      -7.908   6.785  -1.311  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.019   6.327  -0.216  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -5.683   5.747  -0.661  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -4.708   6.050   0.013  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.728   5.352   0.732  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.620   6.137   1.676  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.560   6.770   1.223  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.313   6.173   2.959  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.434   7.466  -1.890  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.205   6.004  -1.879  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -8.733   7.210  -0.902  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.754   7.204   0.378  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.324   4.666   0.162  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.996   4.787   1.311  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.513   5.701   3.351  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.923   6.730   3.536  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.615   4.880  -1.688  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.406   4.163  -2.156  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.837   3.130  -1.158  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.364   2.071  -1.568  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.322   5.161  -2.622  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.769   6.069  -3.790  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.562   7.551  -3.463  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.001   5.730  -5.068  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.452   4.624  -2.189  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.692   3.585  -3.037  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.057   5.785  -1.790  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.440   4.595  -2.923  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.830   5.921  -3.991  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.099   7.813  -2.552  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.502   7.762  -3.318  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.938   8.167  -4.281  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.934   5.911  -4.924  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -3.157   4.681  -5.323  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.359   6.350  -5.889  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.941   3.391   0.150  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.446   2.538   1.230  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.000   1.103   1.182  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.277   0.167   1.508  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.738   3.210   2.583  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.672   2.927   3.623  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.765   1.788   4.444  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.567   3.795   3.740  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.751   1.512   5.382  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.550   3.520   4.672  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.641   2.375   5.495  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.344   2.091   6.389  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.221   4.340   0.385  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.363   2.475   1.122  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.797   4.271   2.433  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.711   2.883   2.955  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.607   1.120   4.349  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.493   4.677   3.117  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.801   0.643   6.018  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.291   4.191   4.755  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.086   2.690   6.302  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.249   0.909   0.731  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.862  -0.418   0.547  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.108  -1.223  -0.524  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.705  -2.359  -0.275  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.371  -0.307   0.207  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.145   0.575   1.218  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.018  -1.702   0.164  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.506   1.935   0.617  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.779   1.731   0.489  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.769  -0.964   1.487  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.472   0.126  -0.790  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.048   0.069   1.502  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.554   0.726   2.123  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.562  -2.315  -0.613  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.904  -2.200   1.127  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.081  -1.610  -0.065  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.611   2.423   0.233  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.219   1.799  -0.198  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.963   2.563   1.384  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.883  -0.627  -1.705  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.097  -1.237  -2.779  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.654  -1.511  -2.339  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.134  -2.592  -2.614  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.124  -0.349  -4.035  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.446  -0.464  -4.826  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.302   0.803  -4.886  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.896   1.911  -4.564  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.545   0.678  -5.313  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.163   0.337  -1.814  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.533  -2.207  -3.026  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -3.993   0.673  -3.735  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.318  -0.674  -4.696  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.203  -0.745  -5.833  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.054  -1.268  -4.411  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.934  -0.208  -5.587  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -8.048   1.544  -5.402  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.027  -0.572  -1.618  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.693  -0.764  -1.047  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.644  -1.917  -0.026  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.231  -2.778  -0.111  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.213   0.557  -0.443  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.169   0.505   0.124  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.314   0.542  -0.597  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.577   0.373   1.518  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.396   0.430   0.252  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.001   0.346   1.569  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.887   0.268   2.747  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.712   0.258   2.772  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.592   0.150   3.960  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.998   0.165   3.978  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.505   0.316  -1.478  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.010  -1.033  -1.856  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.234   1.306  -1.211  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.898   0.860   0.348  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.368   0.630  -1.674  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.370   0.409  -0.063  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.194   0.280   2.749  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.792   0.247   2.758  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.046   0.055   4.888  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.527   0.092   4.916  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.605  -2.000   0.907  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.710  -3.134   1.832  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.929  -4.466   1.106  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.324  -5.461   1.502  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.824  -2.903   2.868  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.460  -1.924   4.000  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.711  -1.690   4.853  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.353  -2.460   4.918  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.291  -1.251   0.973  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.757  -3.234   2.349  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.682  -2.515   2.354  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -3.076  -3.862   3.324  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.134  -0.976   3.579  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.496  -1.248   4.240  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -4.067  -2.637   5.262  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.483  -1.016   5.677  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.664  -3.401   5.371  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.433  -2.614   4.360  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.147  -1.735   5.706  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.718  -4.492   0.018  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.894  -5.686  -0.829  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.564  -6.220  -1.379  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.459  -7.409  -1.665  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.864  -5.370  -1.980  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.388  -6.622  -2.718  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -4.505  -6.437  -4.242  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -3.209  -6.745  -5.018  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -2.118  -5.779  -4.739  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.231  -3.643  -0.211  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.325  -6.477  -0.214  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.705  -4.839  -1.577  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.360  -4.716  -2.685  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -3.715  -7.435  -2.526  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.377  -6.849  -2.317  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.276  -7.091  -4.602  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -4.855  -5.430  -4.471  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -2.873  -7.727  -4.745  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -3.446  -6.733  -6.086  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -2.396  -4.819  -4.880  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -1.774  -5.854  -3.793  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -1.282  -5.906  -5.304  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.551  -5.368  -1.570  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.787  -5.808  -1.980  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.595  -6.452  -0.830  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.685  -6.970  -1.090  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.594  -4.630  -2.566  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.973  -3.926  -3.776  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.255  -4.603  -4.551  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.306  -2.727  -3.970  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.687  -4.388  -1.343  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.689  -6.562  -2.762  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.719  -3.900  -1.790  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.559  -5.017  -2.894  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.155  -6.367   0.440  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.920  -6.800   1.627  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.495  -5.666   2.504  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.323  -5.931   3.387  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.231  -5.972   0.604  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.260  -7.399   2.254  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.750  -7.439   1.326  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.078  -4.413   2.271  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.452  -3.248   3.072  1.00  0.00           C  
+ATOM    179  C   GLY A  11       3.971  -2.986   3.103  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.593  -2.901   2.043  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.509  -4.255   1.448  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.968  -2.368   2.650  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.064  -3.396   4.078  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.608  -2.840   4.289  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.049  -2.569   4.388  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.947  -3.622   3.719  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.100  -3.334   3.404  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.365  -2.497   5.887  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.019  -2.212   6.546  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.017  -2.897   5.618  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.252  -1.600   3.932  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.768  -3.428   6.235  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.091  -1.712   6.104  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       4.978  -2.632   7.532  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       4.836  -1.136   6.553  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.866  -3.916   5.917  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.061  -2.377   5.665  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.430  -4.838   3.502  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.167  -5.968   2.930  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.113  -6.043   1.392  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.652  -6.980   0.805  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.723  -7.269   3.614  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.376  -7.634   3.349  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.454  -4.968   3.734  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.222  -5.839   3.177  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       7.360  -8.063   3.274  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.865  -7.162   4.691  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.737  -6.918   3.537  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.508  -5.047   0.733  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.226  -5.028  -0.713  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.223  -4.235  -1.564  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.035  -4.116  -2.774  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.854  -4.397  -0.935  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.928  -5.006  -0.081  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.017  -4.350   1.287  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.196  -6.052  -1.088  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.903  -3.346  -0.722  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.546  -4.527  -1.971  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.589  -5.837  -0.501  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.236  -3.613  -0.954  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.241  -2.785  -1.634  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.755  -1.388  -2.056  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.534  -0.439  -2.013  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.306  -3.739   0.046  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.102  -2.664  -0.978  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.576  -3.308  -2.531  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.484  -1.243  -2.458  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       6.866   0.043  -2.822  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.607   0.907  -1.567  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.048   0.385  -0.598  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       5.566  -0.231  -3.600  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.057   1.011  -4.351  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.793   0.732  -5.180  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.079  -0.101  -6.363  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.877  -1.406  -6.533  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.266  -2.191  -5.676  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.308  -1.979  -7.632  1.00  0.00           N  
+ATOM    238  H   ARG A  16       6.937  -2.095  -2.518  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       7.569   0.558  -3.476  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.749  -1.013  -4.312  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       4.793  -0.580  -2.914  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       4.834   1.777  -3.634  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       5.843   1.374  -5.018  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.079   0.222  -4.562  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.407   1.693  -5.529  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.530   0.371  -7.128  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.673  -1.883  -4.893  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.162  -3.167  -5.861  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.765  -1.448  -8.350  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.157  -2.963  -7.759  1.00  0.00           H  
+ATOM    251  N   PRO A  17       6.947   2.213  -1.560  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.730   3.085  -0.400  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.232   3.312  -0.095  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.400   3.172  -0.996  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.438   4.403  -0.744  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.414   4.433  -2.270  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.583   2.961  -2.635  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.208   2.638   0.471  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.907   5.241  -0.336  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.472   4.360  -0.399  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.481   4.818  -2.635  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.216   5.048  -2.679  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.104   2.750  -3.572  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.643   2.709  -2.673  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.878   3.687   1.151  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.495   3.929   1.554  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.938   5.209   0.903  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.617   6.239   0.913  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.524   4.048   3.081  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.937   4.549   3.376  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.775   3.886   2.283  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.889   3.069   1.280  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.789   4.750   3.425  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       3.390   3.061   3.527  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.989   5.618   3.306  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       5.272   4.261   4.373  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.593   4.522   2.003  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       6.135   2.918   2.635  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.706   5.185   0.359  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.071   6.373  -0.198  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.534   7.279   0.922  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.005   6.793   1.925  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.043   5.831  -1.093  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.475   4.546  -0.383  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.817   4.036   0.254  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.785   6.932  -0.806  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.857   6.527  -1.157  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.371   5.580  -2.071  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.216   4.752   0.365  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.885   3.819  -1.084  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.616   3.632   1.228  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.276   3.286  -0.389  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.660   8.597   0.722  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.150   9.654   1.607  1.00  0.00           C  
+ATOM    295  C   SER A  20      -1.110  10.284   1.016  1.00  0.00           C  
+ATOM    296  O   SER A  20      -2.094  10.380   1.786  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.248  10.701   1.823  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.910  11.534   2.908  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.067  10.639  -0.179  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.051   8.910  -0.152  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.125   9.214   2.563  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.177  10.205   2.031  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.371  11.300   0.918  1.00  0.00           H  
+ATOM    304  HG  SER A  20       0.272  11.069   3.455  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       14                                                                  
+ATOM      1  N   ASN A   1      -6.401   7.662  -1.132  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.275   6.470  -1.269  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.573   5.259  -1.924  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.244   4.408  -2.495  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.588   6.852  -1.993  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.793   6.163  -1.354  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.671   5.136  -0.706  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.977   6.741  -1.450  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.636   7.473  -0.499  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.040   7.938  -2.035  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.938   8.429  -0.749  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.560   6.149  -0.264  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.722   7.915  -1.937  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.537   6.586  -3.050  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.144   7.601  -1.945  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.719   6.237  -0.991  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.236   5.147  -1.843  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.460   4.057  -2.472  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.853   3.067  -1.460  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.274   2.048  -1.840  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.389   4.680  -3.399  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.705   4.592  -4.905  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.639   3.147  -5.409  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.061   5.208  -5.270  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.672   5.849  -1.391  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.127   3.449  -3.079  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.286   5.716  -3.140  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.429   4.188  -3.232  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -2.935   5.159  -5.430  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.666   2.717  -5.172  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.417   2.537  -4.955  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.774   3.127  -6.492  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -5.877   4.592  -4.894  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.138   6.211  -4.856  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.148   5.268  -6.356  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.027   3.341  -0.163  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.458   2.567   0.937  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.944   1.109   0.964  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.174   0.216   1.296  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.759   3.287   2.260  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.564   3.330   3.186  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.297   2.234   4.021  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.713   4.454   3.196  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.182   2.255   4.876  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.605   4.489   4.064  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.339   3.386   4.907  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.697   3.407   5.788  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.543   4.171   0.073  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.375   2.545   0.801  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.061   4.293   2.042  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.593   2.797   2.766  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.954   1.378   4.007  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.904   5.298   2.546  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.969   1.423   5.532  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.032   5.362   4.078  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.695   4.212   6.308  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.199   0.862   0.556  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.795  -0.478   0.440  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -4.969  -1.337  -0.529  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.571  -2.450  -0.193  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.277  -0.384  -0.008  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.120   0.501   0.945  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.894  -1.795  -0.096  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.475   0.918   0.356  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.761   1.657   0.298  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.759  -0.960   1.418  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.306   0.064  -1.002  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.297  -0.048   1.850  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.586   1.423   1.167  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.385  -2.392  -0.852  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.817  -2.302   0.867  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.945  -1.739  -0.379  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.330   1.364  -0.631  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.141   0.060   0.274  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.939   1.657   1.008  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.685  -0.803  -1.722  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -3.904  -1.463  -2.769  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.453  -1.702  -2.326  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -1.920  -2.790  -2.539  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -3.995  -0.617  -4.058  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.421  -1.431  -5.294  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.350  -0.621  -6.194  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.942   0.305  -6.876  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.636  -0.921  -6.208  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -4.991   0.144  -1.894  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.348  -2.442  -2.942  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.713   0.165  -3.902  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.039  -0.132  -4.264  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.546  -1.706  -5.851  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -4.941  -2.342  -4.994  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.025  -1.675  -5.669  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.188  -0.340  -6.815  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.834  -0.719  -1.658  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.498  -0.859  -1.070  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.433  -1.932   0.032  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.497  -2.744   0.055  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.042   0.505  -0.544  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.340   0.516   0.026  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.480   0.543  -0.699  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.754   0.502   1.428  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.565   0.518   0.155  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.179   0.507   1.471  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.081   0.494   2.669  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.905   0.515   2.669  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.798   0.487   3.882  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.205   0.501   3.885  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.329   0.162  -1.554  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.193  -1.170  -1.855  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.076   1.206  -1.355  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.737   0.847   0.222  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.524   0.581  -1.779  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.549   0.548  -0.121  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6       0.001   0.500   2.681  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.985   0.520   2.640  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.267   0.489   4.823  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.747   0.509   4.821  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.429  -1.970   0.928  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.563  -3.019   1.940  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.832  -4.398   1.325  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.302  -5.380   1.840  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.671  -2.661   2.946  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.287  -1.567   3.960  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.511  -1.233   4.821  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.148  -1.999   4.892  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.136  -1.238   0.898  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.618  -3.107   2.473  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.527  -2.321   2.395  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.940  -3.558   3.506  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.976  -0.668   3.433  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.316  -0.864   4.185  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.850  -2.123   5.351  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.257  -0.464   5.550  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.377  -2.965   5.340  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.217  -2.069   4.334  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.013  -1.260   5.680  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.599  -4.488   0.226  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.976  -5.755  -0.427  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.777  -6.638  -0.783  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.856  -7.858  -0.664  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.803  -5.465  -1.696  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.622  -6.677  -2.165  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.863  -6.886  -1.280  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.602  -8.185  -1.607  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -5.801  -9.379  -1.240  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.048  -3.631  -0.094  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.571  -6.320   0.286  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.477  -4.656  -1.488  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.125  -5.174  -2.502  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.937  -6.516  -3.178  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -3.995  -7.568  -2.162  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.553  -6.915  -0.253  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.542  -6.046  -1.435  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.527  -8.206  -1.063  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.842  -8.200  -2.674  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -4.958  -9.420  -1.800  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -5.526  -9.332  -0.267  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.335 -10.225  -1.388  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.693  -6.000  -1.216  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.577  -6.608  -1.609  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.501  -6.893  -0.404  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.502  -7.590  -0.554  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.191  -5.620  -2.609  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.246  -6.195  -3.544  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.842  -6.848  -4.529  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.401  -5.726  -3.445  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.773  -4.997  -1.309  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.386  -7.552  -2.122  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.396  -5.225  -3.212  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.601  -4.770  -2.070  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.138  -6.413   0.799  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.851  -6.634   2.059  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.515  -5.385   2.659  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.469  -5.523   3.433  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.235  -5.953   0.859  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.135  -7.004   2.792  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.606  -7.406   1.922  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.037  -4.182   2.311  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.491  -2.882   2.819  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.020  -2.705   2.788  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.574  -2.593   1.694  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.318  -4.166   1.598  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.060  -2.105   2.191  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.102  -2.739   3.824  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.730  -2.700   3.937  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.196  -2.624   3.971  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.905  -3.715   3.153  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.004  -3.490   2.653  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.587  -2.742   5.450  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.333  -2.306   6.202  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.199  -2.770   5.292  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.504  -1.647   3.594  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.846  -3.754   5.696  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.442  -2.107   5.689  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.275  -2.782   7.162  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.315  -1.219   6.283  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.915  -3.777   5.531  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.335  -2.119   5.426  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.277  -4.888   3.002  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.825  -6.021   2.248  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.595  -5.934   0.728  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.075  -6.791  -0.007  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.342  -7.350   2.853  1.00  0.00           C  
+ATOM    203  OG  SER A  13       4.946  -7.537   2.785  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.343  -4.969   3.391  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.908  -6.013   2.377  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.816  -8.154   2.324  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.647  -7.388   3.900  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.461  -6.757   3.136  1.00  0.00           H  
+ATOM    209  N   SER A  14       5.937  -4.870   0.241  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.582  -4.659  -1.171  1.00  0.00           C  
+ATOM    211  C   SER A  14       6.709  -4.075  -2.046  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.506  -3.867  -3.240  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.394  -3.697  -1.249  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.342  -4.095  -0.399  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.543  -4.204   0.899  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.276  -5.613  -1.607  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.721  -2.717  -0.961  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.025  -3.661  -2.271  1.00  0.00           H  
+ATOM    219  HG  SER A  14       2.975  -3.313   0.029  1.00  0.00           H  
+ATOM    220  N   GLY A  15       7.873  -3.737  -1.470  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       8.999  -3.132  -2.201  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.848  -1.633  -2.516  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.535  -1.130  -3.401  1.00  0.00           O  
+ATOM    224  H   GLY A  15       7.986  -3.973  -0.495  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.912  -3.262  -1.623  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.130  -3.657  -3.149  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.939  -0.924  -1.830  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.559   0.475  -2.105  1.00  0.00           C  
+ATOM    229  C   ARG A  16       7.032   1.175  -0.838  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.351   0.518  -0.047  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.517   0.515  -3.247  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.357  -0.489  -3.097  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.496  -0.583  -4.360  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.700  -1.826  -4.349  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.398  -2.606  -5.380  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.636  -2.252  -6.620  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       2.850  -3.774  -5.180  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.441  -1.405  -1.093  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.452   1.000  -2.443  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.101   1.503  -3.285  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       7.040   0.296  -4.178  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.766  -1.458  -2.886  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.736  -0.217  -2.247  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.834   0.260  -4.400  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       5.162  -0.588  -5.225  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.410  -2.188  -3.456  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.099  -1.379  -6.787  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.425  -2.883  -7.370  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       3.013  -4.274  -4.292  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       2.589  -4.386  -5.930  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.296   2.484  -0.642  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.862   3.230   0.546  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.336   3.464   0.578  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.676   3.310  -0.454  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.636   4.555   0.478  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.830   4.776  -1.020  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.034   3.357  -1.545  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.157   2.685   1.444  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.068   5.354   0.914  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.609   4.434   0.956  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.963   5.230  -1.460  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.689   5.414  -1.228  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.651   3.270  -2.543  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.094   3.104  -1.509  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.762   3.851   1.737  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.324   4.085   1.879  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.832   5.288   1.045  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.507   6.319   1.003  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.085   4.299   3.378  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.437   4.766   3.908  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.429   4.018   3.023  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.803   3.182   1.576  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.333   5.047   3.541  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.823   3.348   3.843  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.548   5.828   3.800  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.568   4.519   4.962  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.330   4.589   2.906  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.634   3.036   3.452  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.660   5.185   0.385  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.102   6.250  -0.443  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.321   7.283   0.390  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.811   7.023   0.804  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.206   5.530  -1.455  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.321   4.332  -0.664  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.850   3.979   0.253  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.900   6.759  -0.984  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.598   6.163  -1.776  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.818   5.174  -2.286  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.190   4.599  -0.094  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.584   3.506  -1.323  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.487   3.671   1.214  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.451   3.202  -0.216  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.922   8.471   0.555  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.386   9.673   1.224  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.416   9.627   2.763  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.001   8.684   3.339  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.018  10.026   0.706  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.373  11.233   1.334  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.165  10.594   3.315  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.888   8.511   0.265  1.00  0.00           H  
+ATOM    301  HA  SER A  20       1.034  10.508   0.958  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.001  10.151  -0.360  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.730   9.255   1.002  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.935  11.116   2.254  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       15                                                                  
+ATOM      1  N   ASN A   1      -5.555   8.004  -1.532  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.571   6.932  -1.361  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.105   5.544  -1.850  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.936   4.715  -2.200  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.897   7.340  -2.038  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.071   6.615  -1.385  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.297   6.771  -0.197  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -9.821   5.802  -2.107  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -4.747   7.831  -0.949  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.271   8.069  -2.500  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -5.951   8.893  -1.252  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.784   6.837  -0.294  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.035   8.399  -1.937  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.861   7.128  -3.108  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.603   5.565  -3.060  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -10.562   5.348  -1.598  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -4.794   5.254  -1.881  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.259   3.990  -2.422  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.783   3.017  -1.328  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.304   1.928  -1.638  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.148   4.316  -3.442  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.647   5.049  -4.702  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -2.468   5.586  -5.520  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.488   4.133  -5.599  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.097   5.917  -1.583  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.044   3.453  -2.954  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -2.418   4.936  -2.958  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.649   3.395  -3.748  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.253   5.904  -4.403  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -1.705   6.004  -4.864  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.024   4.789  -6.119  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -2.821   6.376  -6.183  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.921   3.235  -5.845  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.413   3.854  -5.094  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.743   4.655  -6.521  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.936   3.389  -0.051  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.430   2.642   1.105  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.954   1.198   1.152  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.201   0.279   1.464  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.762   3.414   2.395  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.656   3.341   3.430  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.409   2.135   4.112  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.845   4.468   3.678  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.337   2.043   5.019  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.773   4.382   4.586  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.505   3.158   5.243  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.567   3.040   6.071  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.366   4.282   0.125  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.345   2.592   1.013  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.928   4.444   2.144  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.687   3.030   2.829  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.032   1.273   3.926  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.028   5.403   3.166  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.128   1.119   5.535  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.160   5.252   4.768  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.163   3.787   5.994  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.227   0.988   0.788  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.849  -0.340   0.711  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.125  -1.216  -0.325  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.736  -2.340  -0.013  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.369  -0.238   0.414  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.095   0.818   1.288  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.031  -1.608   0.641  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.378   2.119   0.526  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.784   1.799   0.563  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.728  -0.819   1.684  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.507   0.023  -0.637  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.027   0.405   1.622  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.505   1.038   2.179  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.517  -2.377   0.069  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.986  -1.872   1.699  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.075  -1.566   0.331  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.483   2.471   0.011  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.168   1.948  -0.207  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.711   2.887   1.226  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.916  -0.702  -1.546  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.150  -1.391  -2.590  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.691  -1.624  -2.173  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.176  -2.721  -2.360  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.230  -0.639  -3.931  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.625  -0.733  -4.579  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.546  -0.884  -6.097  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.814  -1.942  -6.641  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.189   0.150  -6.835  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.185   0.257  -1.709  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.580  -2.380  -2.738  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -3.999   0.395  -3.760  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.503  -1.090  -4.608  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.138  -1.583  -4.173  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.209   0.153  -4.330  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.962   1.049  -6.453  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.143  -0.061  -7.818  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.038  -0.638  -1.550  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.680  -0.802  -1.023  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.581  -1.902   0.052  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.370  -2.683   0.054  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.182   0.548  -0.505  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.217   0.527   0.021  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.341   0.528  -0.734  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.664   0.460   1.409  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.445   0.460   0.092  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.088   0.426   1.419  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.014   0.427   2.664  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.837   0.383   2.600  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.756   0.370   3.860  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.163   0.355   3.831  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.505   0.261  -1.452  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.030  -1.112  -1.845  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.227   1.255  -1.311  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.844   0.890   0.290  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.361   0.562  -1.814  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.420   0.464  -0.212  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.065   0.453   2.696  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.916   0.365   2.548  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.242   0.352   4.811  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.723   0.327   4.755  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.576  -2.011   0.945  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.649  -3.105   1.914  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.882  -4.474   1.254  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.265  -5.442   1.698  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.712  -2.809   2.985  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.272  -1.754   4.020  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.470  -1.358   4.888  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.166  -2.267   4.955  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.302  -1.297   0.951  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.678  -3.182   2.402  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.598  -2.454   2.494  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.946  -3.732   3.519  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.907  -0.864   3.508  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.258  -0.942   4.261  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.855  -2.232   5.416  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.169  -0.607   5.619  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.504  -3.160   5.481  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.268  -2.501   4.389  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.914  -1.496   5.684  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.698  -4.571   0.188  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.920  -5.824  -0.568  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.620  -6.483  -1.050  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.511  -7.703  -0.966  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.867  -5.590  -1.762  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.354  -5.831  -1.453  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.249  -4.698  -1.982  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.691  -5.177  -2.180  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.665  -4.079  -1.976  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.180  -3.726  -0.103  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.374  -6.556   0.102  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.752  -4.574  -2.087  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.594  -6.271  -2.572  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.657  -6.753  -1.911  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.512  -5.922  -0.377  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.243  -3.889  -1.277  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.872  -4.334  -2.938  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.798  -5.556  -3.178  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.897  -5.991  -1.480  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.685  -3.817  -0.999  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -8.405  -3.272  -2.528  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.592  -4.377  -2.248  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.639  -5.703  -1.510  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.688  -6.202  -1.905  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.568  -6.674  -0.725  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.581  -7.332  -0.959  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.424  -5.117  -2.708  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.030  -5.128  -4.186  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.004  -4.494  -4.518  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.768  -5.764  -4.970  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.835  -4.715  -1.632  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.559  -7.070  -2.554  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.184  -4.157  -2.293  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.495  -5.299  -2.651  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.193  -6.382   0.530  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.971  -6.722   1.726  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.536  -5.512   2.484  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.434  -5.686   3.319  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.285  -5.945   0.663  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.329  -7.276   2.410  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.805  -7.370   1.457  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.052  -4.294   2.195  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.478  -3.045   2.826  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.005  -2.879   2.813  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.582  -2.906   1.721  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.402  -4.219   1.418  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.046  -2.213   2.270  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.084  -3.016   3.839  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.692  -2.759   3.973  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.152  -2.629   4.039  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.923  -3.746   3.321  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.027  -3.514   2.831  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.510  -2.622   5.531  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.218  -2.200   6.225  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.129  -2.762   5.317  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.435  -1.671   3.598  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.814  -3.599   5.854  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.322  -1.925   5.744  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.154  -2.624   7.209  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.152  -1.112   6.247  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.874  -3.761   5.613  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.237  -2.141   5.389  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.342  -4.949   3.227  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.953  -6.108   2.565  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.835  -6.089   1.028  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.310  -7.013   0.372  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.418  -7.407   3.189  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.049  -7.646   2.925  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.398  -5.042   3.586  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.021  -6.087   2.780  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.986  -8.229   2.798  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.570  -7.367   4.269  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.491  -6.875   3.179  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.261  -5.024   0.445  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.991  -4.891  -1.000  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.137  -4.279  -1.817  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.039  -4.212  -3.040  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.767  -3.997  -1.251  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.740  -4.198  -0.309  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.896  -4.305   1.059  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.772  -5.881  -1.404  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.077  -2.971  -1.206  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.387  -4.198  -2.253  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.989  -3.688   0.498  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.190  -3.753  -1.173  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.278  -3.048  -1.864  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.923  -1.636  -2.363  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.597  -1.125  -3.256  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.230  -3.874  -0.169  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.132  -2.963  -1.193  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.593  -3.638  -2.728  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.874  -1.002  -1.812  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.382   0.330  -2.201  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.915   1.120  -0.964  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.231   0.524  -0.128  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.224   0.134  -3.199  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.717   1.452  -3.807  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.513   1.235  -4.737  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.760   1.773  -6.087  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.414   1.176  -7.078  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       5.904  -0.036  -6.958  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.592   1.801  -8.218  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.386  -1.480  -1.068  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.193   0.866  -2.695  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.564  -0.500  -3.995  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.397  -0.368  -2.693  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.425   2.110  -3.011  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.533   1.921  -4.356  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.318   0.183  -4.813  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.650   1.750  -4.307  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.417   2.701  -6.269  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.763  -0.524  -6.091  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       6.395  -0.483  -7.711  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.241   2.733  -8.353  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.087   1.345  -8.963  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.201   2.434  -0.845  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.709   3.260   0.266  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.174   3.417   0.252  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.553   3.245  -0.801  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.409   4.616   0.102  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.686   4.697  -1.397  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.996   3.247  -1.757  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.014   2.807   1.209  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.770   5.418   0.418  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.355   4.606   0.646  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.826   5.053  -1.931  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.523   5.360  -1.621  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.719   3.047  -2.774  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.056   3.045  -1.589  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.551   3.769   1.395  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.107   3.972   1.479  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.667   5.246   0.736  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.406   6.231   0.715  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.790   4.070   2.975  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.088   4.608   3.577  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.169   3.986   2.696  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.605   3.104   1.061  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.976   4.746   3.152  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.591   3.076   3.371  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.120   5.679   3.526  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.200   4.315   4.621  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.005   4.652   2.605  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.478   3.028   3.113  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.453   5.261   0.157  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.895   6.437  -0.497  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.313   7.426   0.527  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.289   7.024   1.526  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.191   5.879  -1.419  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.709   4.662  -0.648  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.528   4.140   0.072  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.661   6.937  -1.093  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.972   6.598  -1.574  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.264   5.549  -2.354  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.469   4.948   0.054  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.113   3.904  -1.316  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.269   3.796   1.055  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.983   3.342  -0.516  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.435   8.721   0.221  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.096   9.858   0.986  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.738  10.863   0.030  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.078  11.508  -0.677  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.036  10.515   1.790  1.00  0.00           C  
+ATOM    298  OG  SER A  20       1.921  11.080   0.848  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.985  10.935   0.010  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.966   8.976  -0.599  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.871   9.518   1.672  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       0.640  11.279   2.431  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.548   9.780   2.415  1.00  0.00           H  
+ATOM    304  HG  SER A  20       1.284  11.357   0.104  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       16                                                                  
+ATOM      1  N   ASN A   1      -8.985   3.821  -0.843  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.461   2.997  -1.957  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.942   2.892  -1.960  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.453   1.798  -1.714  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.056   3.439  -3.298  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.516   3.025  -3.296  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -11.303   3.596  -2.558  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.879   1.968  -3.997  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.630   3.491   0.044  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.733   4.791  -0.971  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.999   3.760  -0.843  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.800   1.972  -1.795  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.975   4.504  -3.404  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.543   2.956  -4.125  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.234   1.458  -4.583  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.851   1.711  -3.928  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.201   3.988  -2.170  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.729   4.023  -2.199  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.037   3.168  -1.116  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.314   2.226  -1.445  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.249   5.491  -2.208  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.830   6.411  -1.102  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.744   6.981  -0.191  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.610   7.577  -1.716  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.656   4.854  -2.419  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.416   3.587  -3.149  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.181   5.487  -2.102  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -4.495   5.911  -3.186  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.519   5.848  -0.473  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.233   6.180   0.339  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.013   7.542  -0.773  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.187   7.648   0.549  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -4.940   8.203  -2.305  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -6.406   7.203  -2.358  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -6.050   8.182  -0.924  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.276   3.462   0.168  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.662   2.734   1.282  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.055   1.248   1.304  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.199   0.393   1.521  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -4.017   3.443   2.599  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -3.241   2.974   3.819  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.832   2.899   3.785  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -3.928   2.662   5.010  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.115   2.469   4.918  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -3.214   2.261   6.153  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -1.810   2.142   6.104  1.00  0.00           C  
+ATOM     47  OH  TYR A   3      -1.150   1.670   7.197  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.837   4.272   0.378  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.581   2.779   1.145  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.831   4.492   2.471  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -5.087   3.318   2.784  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.288   3.179   2.895  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -5.005   2.735   5.060  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.037   2.418   4.887  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -3.725   2.015   7.071  1.00  0.00           H  
+ATOM     56  HH  TYR A   3      -0.473   1.035   6.968  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.324   0.935   1.003  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.835  -0.433   0.848  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.070  -1.165  -0.259  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.556  -2.249  -0.010  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.373  -0.454   0.628  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.119   0.069   1.882  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.865  -1.878   0.304  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.406   1.577   1.860  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.933   1.699   0.766  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.626  -0.976   1.772  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.639   0.170  -0.222  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.055  -0.451   1.958  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.537  -0.172   2.773  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.467  -2.211  -0.654  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.552  -2.574   1.084  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.953  -1.892   0.229  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.613   2.129   1.361  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.347   1.759   1.338  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.496   1.941   2.884  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.953  -0.577  -1.456  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.193  -1.137  -2.578  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.737  -1.444  -2.205  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.269  -2.544  -2.502  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.275  -0.188  -3.786  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.565  -0.416  -4.589  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.973   0.808  -5.398  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -7.023   1.388  -5.178  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.173   1.247  -6.352  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.394   0.332  -1.576  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.644  -2.090  -2.855  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.256   0.826  -3.436  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.423  -0.354  -4.446  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.411  -1.237  -5.262  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.383  -0.657  -3.908  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.298   0.808  -6.577  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.526   2.044  -6.855  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.045  -0.512  -1.537  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.676  -0.717  -1.051  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.574  -1.823   0.011  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.277  -2.708  -0.097  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.129   0.610  -0.523  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.281   0.547  -0.017  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.388   0.529  -0.785  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.751   0.483   1.369  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.510   0.450   0.021  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.175   0.431   1.351  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.129   0.466   2.636  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.949   0.390   2.518  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.894   0.408   3.818  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.300   0.384   3.763  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.501   0.381  -1.357  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.053  -1.031  -1.891  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.167   1.328  -1.319  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.772   0.969   0.281  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.399   0.570  -1.868  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.480   0.455  -0.290  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6       0.051   0.501   2.690  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       5.027   0.361   2.446  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.403   0.391   4.779  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.881   0.356   4.673  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.457  -1.813   1.020  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.515  -2.880   2.022  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.825  -4.246   1.392  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.201  -5.233   1.781  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.540  -2.533   3.116  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.096  -1.425   4.093  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.250  -1.130   5.052  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.870  -1.826   4.923  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.129  -1.050   1.079  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.530  -2.978   2.476  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.444  -2.212   2.636  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.739  -3.435   3.698  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.858  -0.515   3.546  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.089  -0.709   4.497  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.566  -2.044   5.557  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.934  -0.410   5.803  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.062  -2.759   5.451  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7       0.000  -1.946   4.281  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.647  -1.045   5.648  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.718  -4.307   0.394  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.085  -5.532  -0.333  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.882  -6.223  -0.984  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.848  -7.448  -1.047  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.149  -5.208  -1.398  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.972  -6.445  -1.780  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.913  -6.206  -2.971  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.170  -6.233  -4.317  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -4.735  -4.890  -4.767  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.216  -3.446   0.170  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.506  -6.236   0.387  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.811  -4.457  -1.010  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.649  -4.799  -2.275  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.296  -7.239  -2.034  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.577  -6.724  -0.915  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.664  -6.972  -2.976  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.467  -5.274  -2.843  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -4.303  -6.857  -4.216  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -5.841  -6.664  -5.066  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.540  -4.295  -4.905  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -4.116  -4.470  -4.084  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -4.232  -4.964  -5.642  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.902  -5.444  -1.456  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.348  -5.945  -2.038  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.310  -6.525  -0.977  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.208  -7.294  -1.310  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.013  -4.797  -2.817  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.703  -5.285  -4.093  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.950  -5.620  -5.038  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.951  -5.273  -4.135  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.024  -4.442  -1.395  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.107  -6.748  -2.738  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.261  -4.080  -3.084  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.722  -4.274  -2.176  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.095  -6.194   0.306  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.925  -6.595   1.444  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.500  -5.422   2.247  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.312  -5.648   3.146  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.256  -5.661   0.510  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.317  -7.196   2.118  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.758  -7.207   1.101  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.118  -4.173   1.938  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.643  -2.980   2.600  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.177  -2.920   2.520  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.704  -2.996   1.404  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.494  -4.036   1.148  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.239  -2.102   2.100  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.298  -2.976   3.632  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.917  -2.819   3.647  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.382  -2.799   3.646  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.030  -4.001   2.943  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.063  -3.835   2.294  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.809  -2.746   5.118  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.582  -2.203   5.844  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.419  -2.739   5.012  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.713  -1.886   3.148  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.061  -3.725   5.477  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.675  -2.096   5.258  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.537  -2.571   6.851  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.587  -1.112   5.807  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.125  -3.710   5.361  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.565  -2.068   5.100  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.415  -5.193   3.014  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.932  -6.420   2.383  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.055  -6.302   0.860  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.865  -6.999   0.255  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.032  -7.613   2.710  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.997  -7.832   4.106  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.544  -5.278   3.527  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.927  -6.625   2.782  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.038  -7.414   2.358  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.424  -8.504   2.218  1.00  0.00           H  
+ATOM    208  HG  SER A  13       5.429  -8.585   4.283  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.287  -5.390   0.254  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.322  -5.050  -1.172  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.593  -4.289  -1.582  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.834  -4.108  -2.773  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.101  -4.192  -1.567  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.017  -4.292  -0.662  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.633  -4.881   0.831  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.280  -5.977  -1.745  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.409  -3.165  -1.614  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.775  -4.489  -2.563  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.222  -3.726   0.121  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.386  -3.785  -0.622  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.603  -3.011  -0.885  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.362  -1.593  -1.427  1.00  0.00           C  
+ATOM    223  O   GLY A  15      10.306  -0.952  -1.881  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.154  -3.973   0.353  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.169  -2.923   0.042  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.220  -3.549  -1.606  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.117  -1.096  -1.381  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.691   0.212  -1.899  1.00  0.00           C  
+ATOM    229  C   ARG A  16       7.091   1.060  -0.764  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.300   0.516   0.009  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.671  -0.025  -3.030  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       6.236   1.275  -3.721  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       5.149   1.034  -4.770  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.730   2.310  -5.382  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.684   2.515  -6.172  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       2.874   1.539  -6.511  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       3.433   3.717  -6.637  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.418  -1.684  -0.950  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.564   0.718  -2.312  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       7.115  -0.671  -3.763  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.791  -0.523  -2.617  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.857   1.951  -2.979  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       7.100   1.731  -4.204  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.533   0.385  -5.534  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.293   0.562  -4.283  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.293   3.114  -5.162  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.073   0.618  -6.161  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.086   1.696  -7.110  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.029   4.490  -6.397  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       2.642   3.867  -7.235  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.386   2.375  -0.671  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.796   3.253   0.346  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.267   3.389   0.203  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.733   3.160  -0.887  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.495   4.609   0.170  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.932   4.600  -1.293  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.291   3.135  -1.522  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.029   2.854   1.334  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.817   5.418   0.362  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.375   4.651   0.813  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.132   4.909  -1.938  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.783   5.259  -1.469  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       8.148   2.870  -2.552  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.319   2.954  -1.207  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.555   3.783   1.280  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.107   3.955   1.251  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.677   5.165   0.399  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.440   6.118   0.240  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.682   4.114   2.714  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.920   4.702   3.385  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.071   4.058   2.612  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.660   3.050   0.846  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.846   4.781   2.800  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.472   3.133   3.140  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.940   5.770   3.288  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.960   4.460   4.446  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.906   4.730   2.557  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.353   3.118   3.092  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.446   5.145  -0.145  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.886   6.247  -0.912  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.347   7.353   0.009  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.657   7.156   0.691  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.216   5.613  -1.764  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.713   4.453  -0.902  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.539   4.007  -0.154  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.645   6.666  -1.575  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.005   6.315  -1.954  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.222   5.216  -2.681  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.473   4.780  -0.218  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.118   3.650  -1.516  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.289   3.725   0.851  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.012   3.193  -0.700  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.994   8.526  -0.049  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.653   9.774   0.659  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.918   9.764   2.177  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.442  10.754   2.789  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -0.786  10.208   0.336  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -0.959  11.455   0.965  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.603   8.846   2.675  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.867   8.518  -0.553  1.00  0.00           H  
+ATOM    301  HA  SER A  20       1.307  10.553   0.271  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -0.919  10.302  -0.725  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.495   9.494   0.758  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.420  11.315   1.824  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       17                                                                  
+ATOM      1  N   ASN A   1      -8.598   5.262  -0.292  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.658   3.999  -1.068  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.282   3.479  -1.479  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.038   2.293  -1.290  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.633   4.090  -2.256  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -11.034   3.705  -1.797  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -11.203   2.706  -1.121  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -12.056   4.485  -2.091  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.871   5.210   0.409  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.409   6.043  -0.906  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.483   5.425   0.171  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -9.048   3.224  -0.405  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.644   5.095  -2.633  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.339   3.378  -3.028  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.996   5.318  -2.653  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.946   4.132  -1.770  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.367   4.322  -1.982  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.025   3.900  -2.419  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.243   3.096  -1.364  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.570   2.120  -1.698  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.224   5.145  -2.840  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.672   5.767  -4.178  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.897   7.063  -4.418  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.426   4.814  -5.354  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.595   5.288  -2.162  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.133   3.236  -3.278  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.329   5.887  -2.073  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.170   4.876  -2.925  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.734   6.008  -4.131  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.056   7.754  -3.588  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.832   6.853  -4.509  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.248   7.538  -5.334  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.421   4.393  -5.292  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.156   4.005  -5.345  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.526   5.349  -6.297  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.383   3.462  -0.084  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.757   2.758   1.034  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.175   1.279   1.120  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.350   0.425   1.441  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -4.083   3.494   2.342  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -3.021   3.296   3.403  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.860   4.092   3.363  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -3.175   2.317   4.405  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.846   3.906   4.317  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -2.162   2.132   5.366  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.992   2.923   5.318  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.011   2.729   6.217  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.910   4.298   0.109  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.678   2.791   0.884  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.169   4.543   2.134  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -5.054   3.166   2.719  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.741   4.850   2.600  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -4.067   1.705   4.436  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.050   4.506   4.296  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -2.281   1.396   6.145  1.00  0.00           H  
+ATOM     56  HH  TYR A   3      -0.092   1.913   6.709  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.434   0.963   0.782  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.959  -0.407   0.754  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.234  -1.224  -0.323  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.791  -2.341  -0.056  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.489  -0.415   0.505  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.287   0.574   1.386  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.084  -1.834   0.645  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -7.998   0.474   2.893  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -6.027   1.699   0.419  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.758  -0.874   1.720  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.652  -0.114  -0.531  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.051   1.571   1.066  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.351   0.403   1.219  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.310  -2.600   0.624  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -8.633  -1.940   1.582  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.777  -2.015  -0.176  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.679  -0.532   3.164  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -7.214   1.179   3.165  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.902   0.718   3.451  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.082  -0.658  -1.529  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.322  -1.281  -2.612  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.862  -1.527  -2.213  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.351  -2.625  -2.425  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.396  -0.435  -3.898  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.293  -1.073  -4.971  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.805  -0.728  -6.375  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.736   0.424  -6.768  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.436  -1.716  -7.169  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.436   0.282  -1.657  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.757  -2.263  -2.799  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.789   0.532  -3.651  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.390  -0.336  -4.310  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.281  -2.139  -4.848  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.316  -0.718  -4.849  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.461  -2.680  -6.883  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -4.101  -1.424  -8.072  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.207  -0.530  -1.604  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.837  -0.672  -1.104  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.705  -1.777  -0.043  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.217  -2.593  -0.114  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.347   0.675  -0.564  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.007   0.616   0.072  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.190   0.555  -0.580  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.332   0.576   1.493  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.222   0.465   0.337  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.749   0.489   1.629  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.572   0.607   2.680  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.387   0.464   2.876  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.201   0.554   3.937  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.602   0.496   4.040  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.687   0.361  -1.494  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.192  -0.960  -1.936  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.308   1.372  -1.379  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -1.057   1.038   0.178  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.302   0.568  -1.656  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.213   0.428   0.099  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.505   0.677   2.615  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.464   0.415   2.929  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.600   0.564   4.832  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.067   0.481   5.014  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.635  -1.843   0.921  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.657  -2.918   1.915  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.850  -4.300   1.279  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.189  -5.245   1.705  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.734  -2.654   2.978  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.362  -1.573   4.010  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.534  -1.401   4.981  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.117  -1.940   4.827  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.351  -1.119   0.959  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.679  -2.957   2.392  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.631  -2.344   2.477  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.923  -3.583   3.518  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.187  -0.627   3.506  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.451  -1.204   4.427  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.657  -2.303   5.579  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.341  -0.562   5.647  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.237  -2.927   5.274  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.232  -1.942   4.191  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.962  -1.204   5.615  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.693  -4.415   0.243  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.927  -5.668  -0.497  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.653  -6.277  -1.088  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.528  -7.496  -1.107  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.973  -5.432  -1.602  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.211  -6.326  -1.434  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.475  -5.580  -1.872  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.711  -6.420  -1.540  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.949  -5.755  -2.006  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.216  -3.585  -0.025  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.295  -6.407   0.215  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.282  -4.405  -1.571  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.535  -5.617  -2.585  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.095  -7.207  -2.035  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.330  -6.615  -0.390  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.532  -4.641  -1.355  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.425  -5.375  -2.942  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.625  -7.376  -2.020  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.744  -6.556  -0.456  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.883  -4.758  -1.855  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -9.086  -5.926  -2.995  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.750  -6.109  -1.500  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.716  -5.437  -1.534  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.596  -5.859  -2.042  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.481  -6.488  -0.941  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.363  -7.284  -1.255  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.292  -4.644  -2.692  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.005  -4.972  -4.012  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.283  -5.311  -4.975  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.245  -4.797  -4.077  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.933  -4.447  -1.525  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.434  -6.621  -2.808  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.551  -3.893  -2.885  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.002  -4.208  -1.987  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.219  -6.165   0.339  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.000  -6.593   1.510  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.552  -5.441   2.368  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.421  -5.669   3.222  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.387  -5.611   0.509  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.359  -7.205   2.144  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.843  -7.202   1.190  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.100  -4.200   2.127  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.565  -3.016   2.844  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.085  -2.823   2.696  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.601  -2.976   1.581  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.469  -4.062   1.347  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.060  -2.134   2.448  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.283  -3.131   3.889  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.824  -2.520   3.787  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.277  -2.307   3.754  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.081  -3.495   3.201  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.203  -3.312   2.737  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.699  -2.018   5.204  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.406  -1.656   5.929  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.342  -2.429   5.160  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.486  -1.429   3.142  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.148  -2.886   5.646  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.420  -1.199   5.254  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.441  -1.968   6.955  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.218  -0.586   5.838  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.219  -3.410   5.578  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.387  -1.911   5.231  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.509  -4.707   3.214  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.159  -5.950   2.773  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.030  -6.225   1.263  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.213  -7.355   0.818  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.698  -7.124   3.649  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.331  -7.475   3.506  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.551  -4.762   3.529  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.229  -5.841   2.949  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       7.291  -7.982   3.396  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.899  -6.873   4.691  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.725  -6.704   3.495  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.763  -5.177   0.472  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.427  -5.256  -0.961  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.393  -4.454  -1.849  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.103  -4.203  -3.018  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.966  -4.835  -1.209  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.155  -4.935  -0.060  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.628  -4.294   0.943  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.505  -6.297  -1.276  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.957  -3.816  -1.545  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.553  -5.447  -2.010  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.335  -4.165   0.528  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.524  -3.999  -1.288  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.526  -3.183  -1.983  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.030  -1.786  -2.384  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.571  -1.198  -3.319  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.702  -4.280  -0.334  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.392  -3.054  -1.335  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.855  -3.702  -2.884  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.999  -1.262  -1.701  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.349   0.019  -2.007  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.893   0.760  -0.731  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.219   0.163   0.112  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.178  -0.191  -2.987  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.135  -1.203  -2.490  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.984  -1.428  -3.468  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.422  -2.198  -4.644  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.985  -2.079  -5.889  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.095  -1.174  -6.226  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.443  -2.867  -6.829  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.637  -1.808  -0.931  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.087   0.627  -2.526  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.690   0.752  -3.140  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.587  -0.548  -3.935  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.627  -2.142  -2.323  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.707  -0.869  -1.550  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.202  -1.967  -2.969  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.580  -0.460  -3.754  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.950  -3.039  -4.447  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.699  -0.623  -5.487  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.736  -1.119  -7.160  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.052  -3.623  -6.563  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.097  -2.799  -7.766  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.222   2.058  -0.583  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.818   2.862   0.570  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.308   3.175   0.566  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.649   2.986  -0.461  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.668   4.136   0.467  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.903   4.302  -1.030  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.972   2.866  -1.536  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.067   2.330   1.490  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.140   4.980   0.866  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.622   3.973   0.971  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.092   4.833  -1.490  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.828   4.841  -1.235  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.531   2.795  -2.511  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.009   2.530  -1.559  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.746   3.667   1.690  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.331   4.024   1.786  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.969   5.219   0.879  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.752   6.167   0.773  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.081   4.342   3.265  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.457   4.738   3.793  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.409   3.874   2.971  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.737   3.158   1.511  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.385   5.152   3.369  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.740   3.441   3.778  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.646   5.781   3.629  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.557   4.542   4.860  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.346   4.379   2.831  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.554   2.911   3.463  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.774   5.216   0.253  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.314   6.299  -0.608  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.874   7.500   0.242  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.165   7.445   0.901  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.174   5.693  -1.433  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.436   4.648  -0.498  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.761   4.170   0.330  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       2.114   6.607  -1.283  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.549   6.442  -1.694  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.591   5.191  -2.307  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.187   5.087   0.130  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.891   3.829  -1.053  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.466   4.016   1.350  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.161   3.257  -0.105  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.692   8.561   0.244  1.00  0.00           N  
+ATOM    294  CA  SER A  20       1.395   9.850   0.892  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.641  10.781  -0.057  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.191  11.035  -1.153  1.00  0.00           O  
+ATOM    297  CB  SER A  20       2.675  10.542   1.362  1.00  0.00           C  
+ATOM    298  OG  SER A  20       3.385   9.705   2.254  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.453  11.237   0.341  1.00  0.00           O  
+ATOM    300  H   SER A  20       2.495   8.530  -0.365  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.748   9.687   1.754  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       3.293  10.759   0.512  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.412  11.474   1.867  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.522   8.859   1.817  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       18                                                                  
+ATOM      1  N   ASN A   1      -4.790   8.442   0.249  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -5.686   7.485  -0.453  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -4.849   6.300  -0.965  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -3.693   6.208  -0.570  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.519   8.196  -1.544  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.833   7.461  -1.812  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -7.853   6.422  -2.450  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.951   7.930  -1.294  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -4.244   7.939   0.938  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -4.142   8.858  -0.406  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -5.325   9.168   0.704  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.383   7.080   0.282  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -6.738   9.195  -1.220  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -5.944   8.259  -2.469  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.019   8.786  -0.768  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -9.770   7.389  -1.524  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.405   5.376  -1.765  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.751   4.202  -2.378  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.144   3.169  -1.390  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.662   2.112  -1.794  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.724   4.701  -3.418  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.530   3.738  -4.610  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.310   4.230  -5.834  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.051   3.617  -4.978  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.367   5.541  -2.065  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.530   3.669  -2.924  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.059   5.647  -3.798  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.776   4.864  -2.910  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.896   2.747  -4.351  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.363   4.348  -5.581  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.911   5.184  -6.179  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.230   3.497  -6.639  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.642   4.598  -5.223  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.504   3.192  -4.138  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -1.942   2.955  -5.838  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.199   3.443  -0.085  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.520   2.704   0.978  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.955   1.233   1.067  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.129   0.359   1.321  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.753   3.449   2.303  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.583   3.372   3.262  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.356   2.199   4.004  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.718   4.476   3.408  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.265   2.121   4.888  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.634   4.408   4.303  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.399   3.225   5.036  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.654   3.151   5.892  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.531   4.367   0.144  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.450   2.720   0.763  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.942   4.482   2.082  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.647   3.061   2.792  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.021   1.359   3.886  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.875   5.381   2.835  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.080   1.223   5.456  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.025   5.255   4.425  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.402   3.418   6.779  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.239   0.944   0.809  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.793  -0.418   0.803  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.137  -1.278  -0.294  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.777  -2.429  -0.051  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.337  -0.377   0.654  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.002   0.564   1.695  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.933  -1.789   0.786  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.600   1.821   1.047  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.855   1.722   0.628  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.561  -0.884   1.762  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.578  -0.019  -0.348  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.786   0.027   2.194  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.278   0.868   2.451  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.587  -2.427  -0.028  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.641  -2.235   1.738  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.023  -1.740   0.735  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.889   2.268   0.350  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.514   1.556   0.511  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.845   2.548   1.821  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.930  -0.702  -1.487  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.240  -1.358  -2.602  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.757  -1.594  -2.286  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.238  -2.664  -2.596  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.402  -0.514  -3.877  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.825  -0.583  -4.457  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.299   0.780  -4.949  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.987   1.219  -6.043  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.068   1.504  -4.156  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.142   0.280  -1.577  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.690  -2.336  -2.774  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.176   0.508  -3.643  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.702  -0.864  -4.637  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.832  -1.272  -5.280  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.527  -0.953  -3.709  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.405   1.166  -3.274  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.384   2.362  -4.578  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.087  -0.635  -1.631  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.718  -0.822  -1.137  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.625  -1.935  -0.078  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.234  -2.811  -0.181  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.169   0.510  -0.615  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.231   0.448  -0.086  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.357   0.390  -0.836  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.678   0.412   1.305  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.461   0.324  -0.009  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.102   0.345   1.317  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.032   0.434   2.562  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.852   0.322   2.500  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.773   0.390   3.759  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.179   0.343   3.732  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.569   0.238  -1.442  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.091  -1.137  -1.973  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.191   1.219  -1.420  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.817   0.881   0.178  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.382   0.389  -1.919  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.439   0.289  -0.304  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.045   0.494   2.594  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.931   0.270   2.447  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.262   0.416   4.711  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.741   0.324   4.655  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.535  -1.954   0.908  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.599  -3.028   1.905  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.859  -4.404   1.277  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.246  -5.374   1.719  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.653  -2.718   2.982  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.238  -1.612   3.971  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.451  -1.213   4.816  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.124  -2.058   4.928  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.199  -1.184   0.968  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.619  -3.101   2.378  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.556  -2.409   2.491  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.850  -3.627   3.553  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.894  -0.741   3.419  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.238  -0.826   4.169  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.830  -2.080   5.360  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.169  -0.442   5.533  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.484  -2.855   5.579  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.258  -2.415   4.373  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.808  -1.215   5.538  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.699  -4.500   0.231  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.961  -5.760  -0.490  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.682  -6.440  -0.992  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.618  -7.666  -1.015  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.959  -5.521  -1.641  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.419  -6.827  -2.322  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -3.630  -7.226  -3.585  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -4.103  -6.440  -4.814  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -3.568  -7.025  -6.066  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.215  -3.664  -0.036  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.413  -6.457   0.217  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.821  -5.019  -1.247  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.524  -4.853  -2.384  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.327  -7.623  -1.608  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.470  -6.727  -2.593  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -2.588  -7.026  -3.423  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -3.798  -8.290  -3.759  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.175  -6.459  -4.850  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -3.782  -5.399  -4.713  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -2.555  -6.986  -6.067  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -3.851  -7.992  -6.145  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -3.914  -6.519  -6.870  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.674  -5.659  -1.382  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.615  -6.165  -1.853  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.571  -6.567  -0.705  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.686  -7.014  -0.969  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.231  -5.098  -2.777  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.189  -5.711  -3.799  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.663  -6.222  -4.813  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.416  -5.646  -3.568  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.796  -4.654  -1.332  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.438  -7.059  -2.454  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.441  -4.595  -3.301  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.736  -4.335  -2.183  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.188  -6.375   0.570  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.022  -6.675   1.745  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.601  -5.455   2.475  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.441  -5.624   3.363  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.253  -6.015   0.741  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.412  -7.227   2.460  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.853  -7.319   1.458  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.171  -4.233   2.128  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.595  -2.981   2.757  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.126  -2.821   2.820  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.764  -2.728   1.772  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.579  -4.166   1.309  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.194  -2.157   2.171  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.155  -2.927   3.750  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.762  -2.798   4.014  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.222  -2.711   4.128  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.985  -3.820   3.384  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.141  -3.624   3.019  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.536  -2.771   5.628  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.232  -2.347   6.300  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.159  -2.854   5.339  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.541  -1.745   3.735  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.809  -3.767   5.920  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.357  -2.104   5.890  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.131  -2.805   7.265  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.189  -1.259   6.357  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.884  -3.862   5.583  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.274  -2.223   5.414  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.349  -4.977   3.147  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.954  -6.124   2.463  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.833  -6.062   0.928  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.261  -6.986   0.242  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.368  -7.420   3.048  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.404  -8.335   3.350  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.372  -5.058   3.425  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.023  -6.116   2.682  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.826  -7.190   3.945  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.665  -7.873   2.347  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.993  -7.938   3.997  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.285  -4.971   0.375  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.996  -4.784  -1.057  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.108  -4.082  -1.850  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.920  -3.757  -3.019  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.711  -3.968  -1.193  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.682  -4.612  -0.483  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.894  -4.268   0.998  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.825  -5.757  -1.521  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.865  -2.985  -0.791  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.431  -3.871  -2.241  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.520  -5.494  -0.884  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.256  -3.783  -1.226  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.384  -3.115  -1.892  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.136  -1.644  -2.261  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.906  -1.080  -3.037  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.354  -4.097  -0.270  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.260  -3.161  -1.246  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.616  -3.654  -2.812  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.071  -1.022  -1.733  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.620   0.333  -2.073  1.00  0.00           C  
+ATOM    229  C   ARG A  16       7.039   1.042  -0.836  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.265   0.407  -0.118  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.558   0.205  -3.182  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       6.146   1.562  -3.766  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       5.085   1.404  -4.861  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.279   2.408  -5.922  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.427   2.749  -6.879  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.214   2.253  -6.941  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.794   3.604  -7.805  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.498  -1.558  -1.093  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.474   0.889  -2.457  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.958  -0.402  -3.972  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.678  -0.308  -2.787  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.747   2.173  -2.980  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       7.035   2.033  -4.183  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.162   0.422  -5.287  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.099   1.511  -4.406  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       6.183   2.845  -5.952  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.943   1.589  -6.236  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.578   2.515  -7.670  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.722   3.990  -7.801  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.153   3.860  -8.532  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.339   2.336  -0.597  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.761   3.096   0.517  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.236   3.291   0.376  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.700   3.157  -0.728  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.502   4.441   0.515  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.925   4.615  -0.941  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.240   3.185  -1.367  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.966   2.571   1.450  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.852   5.237   0.823  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.390   4.367   1.144  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.129   5.028  -1.529  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.791   5.270  -1.039  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       8.064   3.060  -2.418  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.272   2.943  -1.108  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.530   3.634   1.472  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.086   3.848   1.449  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.698   5.104   0.650  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.420   6.101   0.687  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.662   3.983   2.913  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.925   4.461   3.623  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.046   3.799   2.825  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.610   2.974   1.015  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.872   4.701   3.016  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.373   3.010   3.303  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.006   5.530   3.586  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.940   4.157   4.670  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.918   4.424   2.818  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.270   2.821   3.248  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.537   5.098  -0.033  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.010   6.280  -0.696  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.436   7.257   0.342  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.227   6.870   1.309  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.043   5.743  -1.671  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.579   4.494  -0.969  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.631   3.970  -0.196  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.802   6.778  -1.258  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.825   6.462  -1.825  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.453   5.447  -2.598  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.381   4.744  -0.302  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.944   3.756  -1.684  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.326   3.598   0.763  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.130   3.194  -0.777  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.706   8.552   0.169  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.162   9.640   0.988  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.066  10.872   0.126  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.918  11.303  -0.513  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.092   9.931   2.166  1.00  0.00           C  
+ATOM    298  OG  SER A  20       1.001   8.805   3.014  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.239  11.304   0.086  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.318   8.846  -0.582  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.816   9.367   1.381  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.100  10.060   1.823  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.767  10.828   2.696  1.00  0.00           H  
+ATOM    304  HG  SER A  20       0.609   8.093   2.479  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       19                                                                  
+ATOM      1  N   ASN A   1      -4.711   8.428  -0.250  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -5.482   7.459  -1.069  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -4.637   6.216  -1.384  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -3.508   6.151  -0.914  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.058   8.123  -2.332  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.308   7.368  -2.763  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.229   7.219  -1.982  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.347   6.788  -3.948  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -4.276   7.945   0.525  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -3.969   8.859  -0.792  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -5.313   9.159   0.105  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.326   7.121  -0.463  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -6.310   9.144  -2.119  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -5.314   8.139  -3.131  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -6.635   6.892  -4.653  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.230   6.344  -4.151  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.165   5.225  -2.127  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.498   3.973  -2.561  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.959   3.039  -1.451  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.474   1.944  -1.745  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.435   4.298  -3.639  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.002   4.275  -5.079  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.796   5.613  -5.794  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.342   3.164  -5.900  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.111   5.349  -2.465  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.264   3.362  -3.041  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.039   5.276  -3.444  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.623   3.573  -3.570  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.074   4.082  -5.054  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.302   6.407  -5.250  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.731   5.843  -5.862  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.209   5.556  -6.802  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.271   3.350  -5.990  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -3.499   2.202  -5.413  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.782   3.126  -6.897  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.101   3.418  -0.179  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.547   2.721   0.982  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.035   1.268   1.120  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.246   0.381   1.446  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.866   3.547   2.234  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.864   3.337   3.348  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.722   4.158   3.414  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -3.059   2.315   4.297  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.764   3.952   4.424  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -2.106   2.111   5.311  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.953   2.921   5.370  1.00  0.00           C  
+ATOM     47  OH  TYR A   3      -0.015   2.685   6.326  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.435   4.356  -0.036  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.464   2.693   0.862  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.869   4.586   1.967  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.870   3.311   2.589  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.570   4.949   2.689  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -3.934   1.680   4.247  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.103   4.591   4.475  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -2.233   1.337   6.051  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.804   3.144   6.139  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.316   1.007   0.820  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.898  -0.342   0.812  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.161  -1.235  -0.200  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.707  -2.324   0.147  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.424  -0.311   0.536  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.202   0.658   1.464  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.008  -1.726   0.703  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.481   2.022   0.816  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.901   1.792   0.575  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.743  -0.778   1.800  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.593  -0.010  -0.501  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.140   0.204   1.722  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.659   0.801   2.399  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.552  -2.414  -0.005  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.831  -2.089   1.719  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.082  -1.713   0.513  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.555   2.566   0.645  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.003   1.881  -0.131  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.118   2.609   1.477  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.005  -0.767  -1.445  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.266  -1.471  -2.496  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.794  -1.703  -2.131  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.290  -2.798  -2.375  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.404  -0.714  -3.831  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.577  -1.242  -4.674  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.172  -2.342  -5.657  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.444  -2.266  -6.841  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.511  -3.407  -5.235  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.339   0.164  -1.640  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.705  -2.459  -2.606  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.567   0.326  -3.624  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.485  -0.802  -4.412  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.322  -1.636  -4.010  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.980  -0.410  -5.253  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.079  -3.463  -4.327  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -4.196  -3.952  -6.023  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.131  -0.715  -1.517  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.771  -0.866  -0.989  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.676  -1.954   0.096  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.217  -2.804   0.034  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.278   0.492  -0.481  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.076   0.483   0.156  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.258   0.449  -0.500  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.409   0.516   1.577  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.295   0.438   0.415  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.830   0.499   1.706  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.660   0.554   2.771  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.479   0.537   2.947  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.299   0.565   4.026  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.703   0.571   4.116  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.609   0.176  -1.403  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.117  -1.181  -1.802  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.248   1.167  -1.315  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.989   0.883   0.245  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.367   0.437  -1.575  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.290   0.412   0.180  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.419   0.574   2.716  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.558   0.526   2.988  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.705   0.572   4.929  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.181   0.592   5.084  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.612  -1.982   1.056  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.688  -3.061   2.044  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.950  -4.430   1.398  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.263  -5.384   1.758  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.739  -2.752   3.125  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.322  -1.677   4.150  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.497  -1.435   5.104  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.106  -2.095   4.988  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.302  -1.233   1.088  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.712  -3.148   2.521  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.632  -2.416   2.635  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.947  -3.672   3.673  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.094  -0.746   3.637  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.353  -1.060   4.542  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.770  -2.364   5.605  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.222  -0.700   5.856  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.285  -3.061   5.457  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.217  -2.154   4.362  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.919  -1.351   5.762  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.879  -4.534   0.430  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.176  -5.792  -0.293  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.940  -6.427  -0.932  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.861  -7.649  -0.988  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.234  -5.580  -1.389  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.650  -5.363  -0.841  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.641  -4.855  -1.906  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.271  -5.959  -2.767  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.386  -6.423  -3.863  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.427  -3.700   0.224  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.550  -6.525   0.424  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.957  -4.718  -1.966  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -4.252  -6.467  -2.023  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -6.013  -6.296  -0.455  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.609  -4.626  -0.042  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -7.431  -4.329  -1.405  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.171  -4.105  -2.541  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.499  -6.796  -2.135  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -8.193  -5.560  -3.199  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -6.162  -5.656  -4.484  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -5.528  -6.807  -3.488  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.850  -7.145  -4.401  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -1.006  -5.612  -1.428  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.249  -6.089  -2.012  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.195  -6.700  -0.957  1.00  0.00           C  
+ATOM    161  O   ASP A   9       1.906  -7.655  -1.257  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       0.908  -4.913  -2.751  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.926  -5.376  -3.792  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.079  -5.637  -3.380  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.557  -5.417  -4.986  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.181  -4.614  -1.403  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.021  -6.868  -2.743  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.144  -4.345  -3.245  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.399  -4.255  -2.030  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.167  -6.180   0.281  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.093  -6.534   1.364  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.641  -5.339   2.162  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.484  -5.529   3.044  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.409  -5.539   0.486  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.576  -7.194   2.060  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.946  -7.076   0.955  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.182  -4.110   1.882  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.599  -2.906   2.599  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.124  -2.698   2.547  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.696  -2.700   1.453  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.532  -3.983   1.113  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.116  -2.047   2.140  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.249  -2.984   3.627  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.822  -2.540   3.693  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.282  -2.419   3.719  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.024  -3.621   3.110  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.145  -3.463   2.631  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.668  -2.252   5.194  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.381  -1.788   5.872  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.292  -2.472   5.049  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.564  -1.518   3.171  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.000  -3.185   5.608  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.469  -1.522   5.318  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.348  -2.107   6.896  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.287  -0.705   5.777  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.098  -3.457   5.427  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.371  -1.895   5.104  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.411  -4.816   3.098  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.038  -6.057   2.614  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.028  -6.197   1.080  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.416  -7.241   0.562  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.390  -7.277   3.283  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.567  -7.211   4.686  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.434  -4.862   3.375  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.085  -6.051   2.913  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.341  -7.291   3.057  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.867  -8.188   2.919  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.098  -6.440   5.015  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.620  -5.147   0.358  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.465  -5.116  -1.104  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.520  -4.277  -1.839  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.383  -4.035  -3.039  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.072  -4.582  -1.431  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.112  -5.580  -1.231  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.276  -4.349   0.876  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.531  -6.130  -1.502  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.854  -3.747  -0.793  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.022  -4.287  -2.477  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.651  -5.690  -2.148  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.549  -3.780  -1.139  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.587  -2.933  -1.741  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.096  -1.536  -2.151  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.726  -0.894  -2.987  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.618  -4.033  -0.161  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.410  -2.813  -1.039  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.975  -3.426  -2.634  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.969  -1.073  -1.587  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.285   0.177  -1.944  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.807   0.935  -0.691  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.125   0.336   0.145  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.131  -0.110  -2.930  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.136  -1.187  -2.454  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.995  -1.438  -3.443  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.473  -2.075  -4.685  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.016  -1.881  -5.916  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.041  -1.038  -6.174  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.543  -2.530  -6.926  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.539  -1.660  -0.885  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.004   0.797  -2.475  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.588   0.802  -3.085  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.569  -0.435  -3.874  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.671  -2.106  -2.312  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.696  -0.891  -1.507  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.270  -2.080  -2.981  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.510  -0.485  -3.654  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.199  -2.769  -4.574  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.612  -0.568  -5.400  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.697  -0.911  -7.106  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.261  -3.213  -6.759  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.184  -2.398  -7.852  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.131   2.235  -0.537  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.706   3.032   0.616  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.183   3.290   0.607  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.540   3.099  -0.429  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.514   4.332   0.509  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.726   4.499  -0.992  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.879   3.059  -1.478  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.972   2.511   1.537  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.963   5.160   0.913  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.479   4.197   1.000  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.880   4.973  -1.451  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.611   5.095  -1.213  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.476   2.955  -2.467  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.931   2.771  -1.454  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.594   3.738   1.736  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.165   4.041   1.816  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.783   5.192   0.871  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.492   6.199   0.824  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.894   4.397   3.281  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.254   4.847   3.808  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.233   3.978   3.023  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.603   3.146   1.565  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.175   5.190   3.354  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.571   3.506   3.818  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.419   5.889   3.610  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.347   4.691   4.883  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.166   4.491   2.889  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.375   3.027   3.537  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.669   5.075   0.121  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.193   6.145  -0.742  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.412   7.189   0.066  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.366   6.839   0.959  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.286   5.445  -1.758  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.334   4.311  -0.945  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.787   3.922   0.021  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       2.027   6.623  -1.257  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.469   6.113  -2.125  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.899   5.024  -2.558  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.202   4.649  -0.412  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.632   3.479  -1.581  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.379   3.683   0.984  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.349   3.085  -0.391  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.545   8.452  -0.361  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.267   9.613   0.032  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.099  10.270   1.361  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.001   9.777   2.071  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.745   9.233   0.059  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.498  10.392  -0.203  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.596  11.284   1.612  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.265   8.618  -1.047  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.121  10.385  -0.723  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.944   8.492  -0.691  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.994   8.859   1.055  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -2.028  11.083   0.314  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       20                                                                  
+ATOM      1  N   ASN A   1      -8.559   6.374  -1.226  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.539   6.170  -0.168  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.191   5.649  -0.655  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -5.194   6.053  -0.072  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.062   5.285   0.966  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.992   6.102   1.840  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.159   6.243   1.517  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.488   6.730   2.886  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.207   6.992  -1.945  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.827   5.491  -1.639  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.389   6.786  -0.814  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.316   7.145   0.269  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.596   4.450   0.554  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.238   4.906   1.572  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.518   6.672   3.157  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -9.151   7.262   3.426  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.126   4.735  -1.642  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.891   4.125  -2.180  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.153   3.176  -1.204  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.597   2.164  -1.636  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.962   5.228  -2.759  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.563   5.018  -4.237  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.974   6.221  -5.092  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.055   4.808  -4.389  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.972   4.387  -2.062  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.209   3.487  -3.002  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.470   6.170  -2.679  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.068   5.296  -2.140  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.066   4.139  -4.638  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.024   6.461  -4.923  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.363   7.091  -4.843  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.839   5.983  -6.147  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.524   5.712  -4.089  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.743   3.967  -3.772  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -1.820   4.596  -5.432  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.202   3.452   0.106  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.575   2.669   1.174  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.020   1.200   1.203  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.195   0.322   1.447  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.843   3.340   2.530  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.673   3.212   3.480  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.543   2.088   4.320  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.689   4.217   3.496  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.427   1.974   5.172  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.574   4.112   4.346  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.438   2.983   5.184  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.646   2.858   5.993  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.568   4.369   0.345  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.498   2.677   1.000  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.041   4.382   2.366  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.737   2.911   2.988  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.296   1.314   4.305  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.794   5.082   2.856  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.307   1.120   5.821  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.166   4.899   4.359  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.278   3.565   5.851  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.303   0.928   0.911  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.843  -0.436   0.816  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.054  -1.237  -0.220  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.584  -2.327   0.084  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.357  -0.449   0.483  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.184   0.429   1.452  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.909  -1.886   0.515  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.655   1.719   0.779  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.915   1.709   0.742  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.704  -0.925   1.782  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.493  -0.077  -0.536  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.042  -0.126   1.779  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.595   0.676   2.336  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.390  -2.519  -0.204  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.795  -2.311   1.514  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.968  -1.881   0.251  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.807   2.246   0.343  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.375   1.482  -0.007  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.141   2.352   1.521  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.882  -0.682  -1.427  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.187  -1.318  -2.543  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.715  -1.599  -2.195  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.236  -2.714  -2.401  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.359  -0.428  -3.793  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.481  -1.221  -5.109  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -3.302  -1.006  -6.054  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -2.144  -1.029  -5.666  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.557  -0.777  -7.329  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.224   0.258  -1.562  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.671  -2.279  -2.721  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.247   0.161  -3.669  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.541   0.293  -3.855  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.542  -2.266  -4.873  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.394  -0.897  -5.613  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.491  -0.741  -7.700  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -2.737  -0.694  -7.906  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.029  -0.624  -1.578  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.665  -0.788  -1.058  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.556  -1.893   0.011  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.331  -2.745  -0.077  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.159   0.559  -0.523  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.225   0.523   0.051  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.372   0.435  -0.663  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.630   0.513   1.454  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.451   0.386   0.196  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.054   0.444   1.511  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.945   0.537   2.688  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.767   0.433   2.717  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.648   0.497   3.907  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.054   0.465   3.925  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.509   0.259  -1.436  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.018  -1.090  -1.882  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.168   1.265  -1.331  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.840   0.912   0.252  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.432   0.386  -1.739  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.433   0.309  -0.087  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.135   0.584   2.691  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.847   0.386   2.702  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.107   0.502   4.843  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.581   0.457   4.869  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.463  -1.916   0.999  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.525  -3.000   1.984  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.822  -4.357   1.333  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.178  -5.338   1.700  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.557  -2.691   3.086  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.097  -1.666   4.139  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.252  -1.407   5.113  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.893  -2.152   4.958  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.157  -1.171   1.046  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.541  -3.101   2.440  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.443  -2.310   2.615  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.794  -3.620   3.606  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.835  -0.730   3.648  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.113  -1.019   4.569  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.533  -2.334   5.614  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.951  -0.680   5.866  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.114  -3.120   5.409  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.012  -2.241   4.326  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.668  -1.436   5.747  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.738  -4.419   0.353  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.104  -5.647  -0.376  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.891  -6.322  -1.027  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.817  -7.547  -1.040  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.205  -5.340  -1.415  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.335  -6.380  -1.451  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -4.972  -7.663  -2.207  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.125  -8.664  -2.114  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -5.771  -9.943  -2.773  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.250  -3.563   0.145  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.490  -6.354   0.358  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.633  -4.384  -1.181  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.770  -5.224  -2.411  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.586  -6.642  -0.441  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.197  -5.928  -1.944  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -4.786  -7.429  -3.237  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -4.085  -8.111  -1.765  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.345  -8.851  -1.081  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.012  -8.228  -2.581  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.589  -9.789  -3.756  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -4.937 -10.327  -2.348  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.525 -10.610  -2.677  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.939  -5.531  -1.526  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.321  -6.020  -2.093  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.283  -6.607  -1.037  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.139  -7.419  -1.377  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       0.989  -4.858  -2.850  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.796  -5.335  -4.057  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.163  -5.904  -4.975  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.019  -5.073  -4.070  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.118  -4.533  -1.538  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.090  -6.813  -2.809  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.226  -4.185  -3.190  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.629  -4.297  -2.165  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.133  -6.217   0.240  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.010  -6.592   1.355  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.573  -5.411   2.161  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.398  -5.625   3.054  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.303  -5.675   0.461  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.445  -7.224   2.039  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.855  -7.173   0.983  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.155  -4.169   1.875  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.637  -2.966   2.554  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.173  -2.844   2.510  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.743  -2.864   1.419  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.499  -4.036   1.112  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.212  -2.097   2.057  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.276  -2.984   3.579  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.876  -2.729   3.659  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.341  -2.693   3.687  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.005  -3.929   3.062  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.095  -3.815   2.504  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.736  -2.568   5.165  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.479  -2.037   5.847  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.350  -2.640   5.013  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.678  -1.805   3.152  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.012  -3.524   5.567  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.579  -1.889   5.296  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.424  -2.369   6.866  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.453  -0.949   5.767  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.091  -3.614   5.380  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.468  -2.003   5.070  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.350  -5.101   3.114  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.894  -6.348   2.558  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.064  -6.302   1.037  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.806  -7.118   0.493  1.00  0.00           O  
+ATOM    202  CB  SER A  13       5.994  -7.536   2.906  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.670  -8.733   2.580  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.406  -5.120   3.489  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.875  -6.522   3.002  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.770  -7.523   3.955  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.068  -7.474   2.335  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.095  -8.611   1.716  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.380  -5.370   0.366  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.436  -5.119  -1.073  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.612  -4.213  -1.472  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.787  -3.922  -2.655  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.135  -4.433  -1.522  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.021  -4.846  -0.754  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.700  -4.806   0.866  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.525  -6.070  -1.599  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.251  -3.371  -1.420  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.963  -4.657  -2.575  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.267  -4.316  -1.024  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.377  -3.685  -0.506  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.506  -2.771  -0.715  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.108  -1.335  -1.091  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.766  -0.389  -0.660  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.157  -3.928   0.457  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.096  -2.732   0.199  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.140  -3.166  -1.510  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.034  -1.153  -1.871  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.469   0.154  -2.234  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.973   0.913  -0.978  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.211   0.332  -0.200  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.320  -0.061  -3.236  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.701   1.259  -3.728  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.282   1.081  -4.280  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.436   2.223  -3.888  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       2.113   2.270  -3.848  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       1.365   1.261  -4.236  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       1.519   3.348  -3.396  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.609  -2.003  -2.232  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.260   0.723  -2.719  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.701  -0.598  -4.084  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.552  -0.663  -2.744  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.665   1.948  -2.906  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.342   1.711  -4.487  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.323   1.021  -5.351  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.851   0.165  -3.875  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.920   3.015  -3.494  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       1.821   0.446  -4.608  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       0.362   1.295  -4.201  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       2.072   4.122  -3.070  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       0.518   3.399  -3.384  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.293   2.215  -0.808  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.771   3.037   0.288  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.246   3.279   0.193  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.657   3.102  -0.882  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.554   4.355   0.201  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.898   4.468  -1.280  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.151   3.015  -1.674  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.993   2.548   1.239  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.949   5.182   0.518  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.473   4.272   0.782  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.081   4.884  -1.837  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.774   5.093  -1.450  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.895   2.857  -2.704  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.194   2.757  -1.486  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.597   3.714   1.294  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.162   3.983   1.317  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.768   5.182   0.431  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.608   6.024   0.114  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.811   4.228   2.790  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.117   4.740   3.389  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.176   3.963   2.610  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.635   3.096   0.970  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.034   4.962   2.882  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.539   3.285   3.264  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.224   5.797   3.237  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.178   4.547   4.461  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.074   4.543   2.520  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.373   3.011   3.105  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.485   5.278   0.026  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.982   6.372  -0.808  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.682   7.673  -0.045  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.626   8.727  -0.675  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.302   5.824  -1.426  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.825   4.851  -0.371  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.452   4.272   0.229  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.699   6.601  -1.599  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.008   6.612  -1.603  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.052   5.278  -2.333  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.402   5.364   0.374  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.440   4.069  -0.815  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.318   4.081   1.276  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.728   3.363  -0.309  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.482   7.598   1.276  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.266   8.724   2.196  1.00  0.00           C  
+ATOM    295  C   SER A  20       1.329   8.752   3.288  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.742   7.644   3.706  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.141   8.690   2.805  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.374   7.496   3.524  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.652   9.878   3.716  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.581   6.704   1.731  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.368   9.660   1.645  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.251   9.524   3.471  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.884   8.784   2.011  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.759   7.480   4.268  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       21                                                                  
+ATOM      1  N   ASN A   1      -8.205   5.399   0.404  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.421   4.425  -0.695  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.126   3.775  -1.163  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.987   2.568  -1.004  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.214   5.043  -1.856  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.664   5.161  -1.424  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.997   6.047  -0.655  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -11.516   4.226  -1.803  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.624   4.992   1.125  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -7.759   6.235   0.050  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.098   5.664   0.802  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -9.021   3.603  -0.300  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.823   6.015  -2.087  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.147   4.412  -2.743  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.263   3.457  -2.402  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.463   4.349  -1.476  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.172   4.549  -1.692  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.889   4.051  -2.203  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.114   3.184  -1.190  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.509   2.181  -1.570  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.073   5.277  -2.655  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.033   5.475  -4.183  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.073   6.965  -4.529  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.762   4.845  -4.764  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.330   5.538  -1.816  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.081   3.408  -3.065  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.507   6.153  -2.213  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.055   5.173  -2.305  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.900   4.998  -4.643  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.100   7.324  -4.467  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.450   7.536  -3.839  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.711   7.128  -5.545  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.884   5.386  -4.413  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -2.688   3.801  -4.461  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -2.792   4.898  -5.853  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.187   3.525   0.103  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.556   2.775   1.192  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.000   1.305   1.250  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.195   0.429   1.563  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.840   3.474   2.532  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.641   3.483   3.456  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.318   2.335   4.203  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.834   4.634   3.549  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.190   2.334   5.043  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.712   4.643   4.398  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.385   3.488   5.143  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.689   3.483   5.975  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.659   4.384   0.331  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.477   2.787   1.022  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.128   4.489   2.335  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.675   2.981   3.036  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.934   1.451   4.126  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.071   5.516   2.968  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.931   1.461   5.624  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.096   5.527   4.474  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.536   4.026   6.750  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.268   1.027   0.907  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.809  -0.333   0.842  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.065  -1.132  -0.228  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.619  -2.244   0.044  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.333  -0.322   0.572  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.130   0.602   1.523  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.912  -1.748   0.626  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -7.837   0.419   3.019  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.853   1.783   0.573  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.628  -0.825   1.798  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.498   0.045  -0.442  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.904   1.618   1.263  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.195   0.439   1.352  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.438  -2.382  -0.123  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.755  -2.190   1.610  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.983  -1.721   0.418  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.575  -0.614   3.246  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -7.012   1.067   3.316  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.722   0.689   3.595  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.894  -0.554  -1.425  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.180  -1.182  -2.538  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.711  -1.453  -2.172  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.211  -2.547  -2.418  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.321  -0.301  -3.794  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.173  -1.098  -5.104  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -2.956  -0.675  -5.920  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -1.933  -1.333  -5.943  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.020   0.437  -6.629  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.218   0.396  -1.539  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.656  -2.143  -2.729  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.289   0.161  -3.782  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.593   0.512  -3.762  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.079  -2.139  -4.863  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.066  -0.948  -5.712  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.834   1.023  -6.661  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -2.179   0.616  -7.149  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.050  -0.491  -1.510  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.682  -0.649  -1.004  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.552  -1.777   0.033  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.343  -2.619  -0.074  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.195   0.683  -0.426  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.199   0.640   0.118  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.328   0.641  -0.626  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.638   0.542   1.510  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.424   0.533   0.208  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.060   0.471   1.527  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.987   0.512   2.761  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.807   0.373   2.709  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.723   0.410   3.959  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.128   0.343   3.936  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.536   0.387  -1.350  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.035  -0.916  -1.840  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.231   1.421  -1.204  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.865   0.995   0.375  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.362   0.708  -1.706  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.401   0.535  -0.078  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.088   0.583   2.787  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.885   0.322   2.660  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.210   0.395   4.909  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.683   0.276   4.862  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.451  -1.826   1.027  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.482  -2.920   2.000  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.770  -4.274   1.337  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.172  -5.271   1.735  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.494  -2.616   3.120  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.022  -1.536   4.111  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.153  -1.196   5.086  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.804  -1.981   4.934  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.149  -1.086   1.092  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.489  -3.014   2.435  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.409  -2.283   2.668  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.686  -3.532   3.681  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.764  -0.633   3.565  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.027  -0.854   4.530  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.418  -2.076   5.672  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.833  -0.402   5.761  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.025  -2.912   5.456  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7       0.060  -2.128   4.287  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.552  -1.214   5.664  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.622  -4.312   0.302  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.964  -5.533  -0.446  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.748  -6.215  -1.087  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.680  -7.440  -1.095  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.040  -5.202  -1.495  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.019  -6.365  -1.703  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.311  -5.884  -2.382  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.429  -6.917  -2.201  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.063  -6.804  -0.863  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.107  -3.448   0.065  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.372  -6.243   0.275  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.590  -4.341  -1.167  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.577  -4.927  -2.444  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.554  -7.109  -2.321  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.268  -6.792  -0.732  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.615  -4.953  -1.943  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.116  -5.737  -3.446  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -8.176  -6.759  -2.955  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.998  -7.914  -2.334  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.353  -6.774  -0.143  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -8.612  -5.957  -0.808  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.670  -7.595  -0.691  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.774  -5.426  -1.557  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.530  -5.873  -2.078  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.485  -6.399  -0.981  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.573  -6.882  -1.301  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.212  -4.694  -2.814  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.583  -4.991  -4.272  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.662  -5.343  -5.038  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.782  -4.809  -4.612  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.962  -4.430  -1.556  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.358  -6.689  -2.785  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.541  -3.857  -2.802  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.121  -4.414  -2.279  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.125  -6.270   0.304  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.936  -6.685   1.451  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.565  -5.530   2.237  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.424  -5.778   3.084  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.211  -5.877   0.508  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.298  -7.243   2.136  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.735  -7.352   1.125  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.184  -4.272   1.973  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.732  -3.116   2.683  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.265  -3.035   2.545  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.771  -3.134   1.422  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.507  -4.103   1.237  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.296  -2.204   2.279  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.443  -3.201   3.729  1.00  0.00           H  
+ATOM    184  N   PRO A  12       5.029  -2.881   3.651  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.491  -2.829   3.600  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.138  -4.072   2.966  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.211  -3.949   2.375  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.970  -2.642   5.048  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.734  -2.162   5.806  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.578  -2.795   5.033  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.783  -1.953   3.019  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.325  -3.570   5.452  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.775  -1.907   5.107  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.750  -2.505   6.823  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.663  -1.077   5.744  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.362  -3.773   5.418  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.684  -2.179   5.140  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.492  -5.249   3.030  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.032  -6.510   2.502  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.252  -6.475   0.991  1.00  0.00           C  
+ATOM    201  O   SER A  13       8.198  -7.085   0.501  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.085  -7.675   2.806  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.872  -7.807   4.197  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.578  -5.299   3.472  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.994  -6.707   2.977  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.144  -7.497   2.322  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.513  -8.600   2.417  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.506  -8.436   4.551  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.398  -5.751   0.257  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.540  -5.569  -1.189  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.723  -4.673  -1.582  1.00  0.00           C  
+ATOM    212  O   SER A  14       8.110  -4.660  -2.750  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.248  -4.986  -1.771  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.583  -5.979  -2.515  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.654  -5.262   0.743  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.710  -6.543  -1.651  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.614  -4.652  -0.972  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.507  -4.180  -2.451  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.809  -6.342  -2.003  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.298  -3.917  -0.635  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.467  -3.068  -0.877  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.130  -1.720  -1.522  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.898  -1.231  -2.349  1.00  0.00           O  
+ATOM    224  H   GLY A  15       7.970  -4.008   0.322  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.963  -2.879   0.074  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.166  -3.596  -1.527  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.986  -1.120  -1.164  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.493   0.155  -1.712  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.893   1.052  -0.617  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.228   0.526   0.276  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.486  -0.108  -2.852  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.371  -1.121  -2.515  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.390  -1.352  -3.682  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.505  -2.695  -4.282  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.417  -3.159  -5.117  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.381  -2.403  -5.595  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.336  -4.410  -5.482  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.428  -1.572  -0.451  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.348   0.677  -2.139  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.022   0.825  -3.109  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       7.046  -0.475  -3.709  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.827  -2.059  -2.261  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.805  -0.751  -1.666  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.389  -1.227  -3.316  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.531  -0.590  -4.449  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.776  -3.394  -4.104  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       6.393  -1.440  -5.320  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       7.062  -2.775  -6.231  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.489  -4.903  -5.147  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.023  -4.858  -6.055  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.075   2.387  -0.684  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.538   3.322   0.308  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.011   3.481   0.186  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.452   3.191  -0.874  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.258   4.647   0.031  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.545   4.595  -1.468  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.782   3.109  -1.733  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.789   2.972   1.310  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.629   5.482   0.272  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.199   4.671   0.582  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.707   4.957  -2.032  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.418   5.192  -1.732  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.395   2.837  -2.696  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.849   2.890  -1.670  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.330   3.962   1.245  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       2.890   4.179   1.221  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.501   5.385   0.341  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.270   6.342   0.211  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.483   4.404   2.680  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.743   4.989   3.313  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       4.873   4.294   2.554  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.410   3.277   0.849  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.664   5.093   2.748  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.248   3.446   3.144  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.784   6.052   3.175  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.788   4.783   4.383  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.715   4.952   2.453  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.153   3.376   3.072  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.280   5.377  -0.223  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.762   6.450  -1.060  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.382   7.663  -0.198  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.624   7.631   0.512  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.435   5.840  -1.790  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.951   4.783  -0.812  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.299   4.311  -0.088  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.508   6.751  -1.796  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.185   6.582  -1.983  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.088   5.348  -2.699  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.652   5.211  -0.122  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.423   3.952  -1.333  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.083   4.134   0.948  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.683   3.414  -0.572  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.217   8.708  -0.251  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.998  10.004   0.410  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.315  10.992  -0.534  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.887  11.215  -1.624  1.00  0.00           O  
+ATOM    297  CB  SER A  20       2.322  10.595   0.894  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.966   9.680   1.760  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.750  11.510  -0.139  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.987   8.656  -0.900  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.337   9.875   1.267  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       2.954  10.792   0.050  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.127  11.529   1.425  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.007   8.832   1.306  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       22                                                                  
+ATOM      1  N   ASN A   1      -7.147   6.420  -0.321  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.735   5.239  -1.002  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.654   4.233  -1.423  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.828   3.043  -1.189  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.631   5.670  -2.180  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.791   6.178  -3.342  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -6.938   7.030  -3.134  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.925   5.610  -4.527  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.444   6.132   0.344  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.730   7.032  -1.016  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.869   6.934   0.166  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.365   4.712  -0.285  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.211   4.828  -2.507  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.301   6.470  -1.860  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -8.593   4.875  -4.704  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -7.334   5.964  -5.263  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.522   4.698  -1.980  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.409   3.863  -2.457  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.793   2.972  -1.363  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.233   1.920  -1.669  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.326   4.784  -3.046  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.749   5.553  -4.315  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -2.850   6.776  -4.507  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.680   4.665  -5.559  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.460   5.679  -2.226  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.775   3.199  -3.243  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.054   5.502  -2.296  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.440   4.192  -3.280  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.770   5.913  -4.203  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.889   7.409  -3.621  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -1.821   6.467  -4.687  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.206   7.360  -5.357  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.700   4.193  -5.633  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.449   3.893  -5.510  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.847   5.268  -6.452  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.931   3.366  -0.089  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.447   2.623   1.074  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.964   1.180   1.109  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.229   0.272   1.491  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.837   3.358   2.368  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.695   3.445   3.358  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.319   2.321   4.114  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.990   4.653   3.499  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.242   2.408   5.016  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.914   4.751   4.400  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.539   3.622   5.162  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.485   3.702   6.054  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.371   4.256   0.070  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.359   2.584   1.015  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.150   4.353   2.117  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.678   2.850   2.844  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.858   1.392   4.001  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.289   5.504   2.906  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.942   1.554   5.604  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.364   5.678   4.516  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.190   4.071   6.890  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.213   0.963   0.670  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.823  -0.366   0.587  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.035  -1.235  -0.401  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.639  -2.349  -0.066  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.315  -0.267   0.189  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.131   0.588   1.186  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.906  -1.688   0.098  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.426   1.134   0.567  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.742   1.753   0.322  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.754  -0.841   1.568  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.380   0.200  -0.796  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.384  -0.019   2.034  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.554   1.453   1.513  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.613  -2.155  -0.842  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.546  -2.302   0.925  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.995  -1.665   0.139  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.186   1.834  -0.233  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.035   0.325   0.163  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4     -10.000   1.657   1.332  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.770  -0.707  -1.602  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.004  -1.401  -2.634  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.557  -1.659  -2.193  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.034  -2.749  -2.416  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.064  -0.600  -3.951  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.101  -1.517  -5.182  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.437  -2.250  -5.294  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.433  -1.708  -5.744  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.519  -3.495  -4.863  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.062   0.244  -1.779  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.475  -2.372  -2.776  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.948   0.009  -3.946  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.195   0.059  -4.019  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.954  -0.923  -6.064  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -3.280  -2.234  -5.138  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.727  -3.993  -4.495  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.432  -3.902  -4.971  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.937  -0.681  -1.518  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.600  -0.811  -0.937  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.532  -1.917   0.130  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.363  -2.764   0.091  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.164   0.545  -0.369  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.216   0.547   0.205  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.366   0.594  -0.508  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.619   0.456   1.606  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.444   0.504   0.353  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.043   0.441   1.664  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.931   0.375   2.834  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.753   0.369   2.869  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.631   0.287   4.054  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.038   0.291   4.074  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.437   0.199  -1.406  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.095  -1.089  -1.730  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.202   1.270  -1.159  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.861   0.845   0.413  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.421   0.666  -1.584  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.427   0.496   0.079  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.148   0.387   2.825  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.834   0.356   2.853  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.088   0.221   4.984  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.566   0.226   5.014  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.493  -1.950   1.062  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.591  -3.020   2.054  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.887  -4.379   1.416  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.332  -5.379   1.867  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.648  -2.680   3.119  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.204  -1.596   4.116  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.353  -1.276   5.075  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.992  -2.019   4.955  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.199  -1.215   1.063  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.619  -3.132   2.532  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.533  -2.337   2.619  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.884  -3.585   3.682  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.950  -0.690   3.572  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.247  -1.017   4.508  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.565  -2.140   5.705  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.079  -0.432   5.708  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.200  -2.960   5.466  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.115  -2.141   4.324  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.770  -1.251   5.695  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.704  -4.425   0.351  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.024  -5.667  -0.363  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.783  -6.379  -0.902  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.714  -7.603  -0.824  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.029  -5.384  -1.498  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.718  -6.666  -1.991  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.727  -7.192  -0.954  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.697  -8.722  -0.865  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.010  -9.184   0.509  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.166  -3.563   0.071  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.461  -6.347   0.365  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.778  -4.706  -1.137  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.501  -4.924  -2.335  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.236  -6.455  -2.907  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -3.961  -7.422  -2.206  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.484  -6.782   0.007  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.729  -6.861  -1.233  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.422  -9.127  -1.544  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -4.703  -9.081  -1.147  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -5.172  -9.166   1.076  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.699  -8.578   0.933  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.369 -10.130   0.493  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.814  -5.616  -1.411  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.466  -6.130  -1.902  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.395  -6.627  -0.772  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.377  -7.317  -1.041  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.145  -5.018  -2.722  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.033  -5.572  -3.840  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.217  -5.858  -3.563  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.516  -5.670  -4.975  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.985  -4.619  -1.475  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.267  -6.973  -2.567  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.385  -4.401  -3.160  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.730  -4.377  -2.062  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.124  -6.267   0.493  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.948  -6.626   1.656  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.533  -5.439   2.437  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.358  -5.653   3.329  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.279  -5.730   0.656  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.331  -7.206   2.341  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.781  -7.257   1.345  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.128  -4.200   2.126  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.561  -2.998   2.829  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.092  -2.817   2.806  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.667  -2.692   1.724  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.538  -4.070   1.311  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.108  -2.134   2.348  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.187  -3.048   3.848  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.785  -2.805   3.967  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.246  -2.706   4.011  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.976  -3.836   3.263  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.113  -3.645   2.838  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.631  -2.710   5.496  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.341  -2.359   6.233  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.243  -2.888   5.316  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.540  -1.751   3.570  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.984  -3.679   5.793  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.415  -1.982   5.705  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.305  -2.841   7.191  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.252  -1.274   6.318  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.007  -3.905   5.563  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.346  -2.281   5.435  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.332  -4.997   3.071  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.911  -6.174   2.405  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.618  -6.217   0.896  1.00  0.00           C  
+ATOM    201  O   SER A  13       6.579  -7.294   0.305  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.458  -7.466   3.098  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.899  -7.491   4.441  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.358  -5.057   3.358  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.997  -6.129   2.500  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.387  -7.520   3.078  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.893  -8.322   2.581  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.357  -6.887   4.951  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.432  -5.052   0.265  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.076  -4.919  -1.157  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.132  -4.174  -1.984  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.929  -3.921  -3.169  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.715  -4.232  -1.266  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.775  -4.945  -0.496  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.365  -4.227   0.848  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.970  -5.909  -1.604  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.790  -3.226  -0.900  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.396  -4.200  -2.306  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.597  -5.804  -0.924  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.259  -3.794  -1.363  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.337  -3.046  -2.017  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.945  -1.615  -2.403  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.471  -1.083  -3.379  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.370  -4.078  -0.400  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.194  -2.991  -1.346  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.646  -3.574  -2.921  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.005  -1.001  -1.666  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.468   0.335  -1.947  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.939   1.037  -0.683  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.297   0.382   0.141  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.363   0.241  -3.014  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.268  -0.802  -2.713  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.161  -0.846  -3.770  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.681  -1.237  -5.095  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.016  -0.436  -6.099  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       4.910   0.871  -6.014  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.479  -0.936  -7.220  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.638  -1.499  -0.867  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.282   0.927  -2.362  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.895   1.203  -3.097  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.844  -0.019  -3.959  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.727  -1.771  -2.660  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.810  -0.587  -1.750  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.418  -1.558  -3.465  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.662   0.123  -3.814  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.831  -2.228  -5.227  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.571   1.257  -5.151  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       5.171   1.470  -6.773  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.580  -1.932  -7.319  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       5.740  -0.329  -7.975  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.146   2.361  -0.541  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.642   3.137   0.592  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.117   3.361   0.511  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.532   3.158  -0.557  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.416   4.460   0.520  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.671   4.652  -0.972  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.829   3.228  -1.493  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.878   2.623   1.524  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.830   5.268   0.915  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.368   4.346   1.042  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.841   5.143  -1.443  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.569   5.244  -1.152  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.382   3.137  -2.464  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.886   2.963  -1.532  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.468   3.790   1.613  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.035   4.076   1.629  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.678   5.275   0.730  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.501   6.177   0.557  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.681   4.342   3.098  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.998   4.812   3.711  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.049   4.030   2.928  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.502   3.188   1.294  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.929   5.103   3.178  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.369   3.411   3.573  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.128   5.869   3.579  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.048   4.597   4.778  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.952   4.603   2.839  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.240   3.074   3.417  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.456   5.312   0.158  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.020   6.389  -0.730  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.573   7.658   0.014  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.781   8.756  -0.501  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.147   5.799  -1.525  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.739   4.750  -0.582  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.461   4.252   0.217  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.824   6.660  -1.417  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.871   6.555  -1.758  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.235   5.311  -2.422  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.472   5.190   0.066  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.196   3.933  -1.136  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.178   4.064   1.235  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.863   3.356  -0.255  1.00  0.00           H  
+ATOM    293  N   SER A  20      -0.071   7.506   1.180  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.495   8.598   2.070  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.609   8.944   3.064  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.894  10.155   3.181  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.736   8.215   2.879  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.830   7.879   2.044  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.084   7.996   3.730  1.00  0.00           O  
+ATOM    300  H   SER A  20      -0.157   6.569   1.538  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.699   9.493   1.486  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.500   7.370   3.497  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -2.011   9.052   3.523  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -3.169   8.700   1.678  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       23                                                                  
+ATOM      1  N   ASN A   1      -8.995   5.512  -1.807  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.139   5.500  -0.596  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.657   5.213  -0.847  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -5.857   5.704  -0.062  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.684   4.564   0.498  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.123   5.373   1.709  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.305   5.507   1.971  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.201   5.977   2.436  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.610   6.132  -2.507  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -9.086   4.582  -2.189  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.920   5.841  -1.561  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.157   6.511  -0.184  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.524   4.019   0.112  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.920   3.855   0.818  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.210   5.924   2.252  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.568   6.492   3.222  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.287   4.419  -1.870  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.918   3.992  -2.233  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.198   3.117  -1.189  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.649   2.074  -1.544  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.033   5.181  -2.661  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.577   5.992  -3.859  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -5.182   7.328  -3.410  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.464   6.283  -4.867  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.993   4.011  -2.461  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.014   3.355  -3.115  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.937   5.845  -1.824  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.061   4.766  -2.935  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.348   5.414  -4.371  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -6.031   7.162  -2.754  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.432   7.916  -2.879  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -5.517   7.893  -4.282  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.669   6.860  -4.395  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -3.056   5.346  -5.245  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.867   6.848  -5.709  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.220   3.498   0.091  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.550   2.790   1.185  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.980   1.315   1.283  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.150   0.440   1.515  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.809   3.544   2.496  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.752   3.301   3.554  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.869   2.215   4.443  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.653   4.178   3.655  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.899   2.018   5.443  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.683   3.985   4.655  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.812   2.911   5.561  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.085   2.742   6.568  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.660   4.395   0.286  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.478   2.809   0.991  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.840   4.595   2.283  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.790   3.270   2.890  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.710   1.538   4.369  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.555   5.018   2.982  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.977   1.210   6.151  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.149   4.672   4.736  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.563   3.552   6.750  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.264   1.030   1.024  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.827  -0.326   0.952  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.114  -1.151  -0.131  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.658  -2.257   0.147  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.356  -0.272   0.705  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.110   0.581   1.757  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.947  -1.695   0.687  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.451   1.106   1.228  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.870   1.816   0.855  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.652  -0.820   1.909  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.515   0.178  -0.278  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.294  -0.024   2.624  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.523   1.453   2.040  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.530  -2.276  -0.135  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.726  -2.202   1.628  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.028  -1.659   0.555  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.295   1.636   0.288  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.147   0.285   1.062  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.883   1.794   1.955  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.980  -0.613  -1.354  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.248  -1.254  -2.452  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.764  -1.451  -2.115  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.210  -2.510  -2.406  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.397  -0.444  -3.752  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.780  -0.585  -4.421  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.677  -1.049  -5.874  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.908  -0.532  -6.667  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.453  -2.034  -6.287  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.284   0.340  -1.486  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.665  -2.247  -2.623  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.235   0.592  -3.525  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.627  -0.786  -4.446  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.358  -1.301  -3.870  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.280   0.383  -4.410  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.135  -2.486  -5.703  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.309  -2.278  -7.253  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.122  -0.471  -1.467  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.752  -0.626  -0.970  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.626  -1.773   0.051  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.275  -2.606  -0.073  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.246   0.708  -0.409  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.122   0.638   0.187  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.283   0.580  -0.505  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.498   0.590   1.599  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.337   0.446   0.374  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.919   0.485   1.681  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.791   0.638   2.820  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.609   0.442   2.898  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.472   0.592   4.050  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.875   0.504   4.093  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.627   0.394  -1.292  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.116  -0.900  -1.810  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.230   1.425  -1.207  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.932   1.060   0.358  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.377   0.619  -1.579  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.319   0.364   0.099  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.286   0.722   2.803  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.686   0.366   2.903  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.916   0.637   4.976  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.385   0.485   5.046  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.546  -1.866   1.019  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.600  -2.993   1.954  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.891  -4.331   1.257  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.258  -5.322   1.617  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.629  -2.736   3.069  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.255  -1.624   4.066  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.410  -1.464   5.059  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.975  -1.930   4.852  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.238  -1.124   1.101  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.616  -3.103   2.408  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.559  -2.467   2.606  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.758  -3.662   3.632  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.117  -0.684   3.539  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.330  -1.232   4.522  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.546  -2.384   5.627  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.198  -0.653   5.753  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.059  -2.897   5.349  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.117  -1.940   4.182  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.809  -1.154   5.600  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.780  -4.375   0.246  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.068  -5.596  -0.534  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.816  -6.219  -1.151  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.740  -7.439  -1.237  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.081  -5.335  -1.662  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.498  -4.986  -1.175  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.576  -5.917  -1.747  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.443  -7.334  -1.176  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.563  -8.199  -1.611  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.304  -3.525   0.051  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.475  -6.350   0.141  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.719  -4.518  -2.256  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -4.124  -6.228  -2.289  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.519  -5.056  -0.105  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.730  -3.973  -1.499  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -7.544  -5.528  -1.496  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.493  -5.943  -2.836  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.519  -7.762  -1.515  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.423  -7.269  -0.084  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.442  -7.832  -1.266  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.603  -8.242  -2.621  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.442  -9.138  -1.253  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.849  -5.393  -1.556  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.436  -5.853  -2.083  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.332  -6.506  -1.009  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.223  -7.275  -1.345  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.145  -4.662  -2.744  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.097  -5.123  -3.846  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.259  -5.441  -3.507  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.661  -5.116  -5.015  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.027  -4.396  -1.508  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.243  -6.603  -2.852  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.408  -4.009  -3.170  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.699  -4.094  -1.991  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.085  -6.233   0.280  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.935  -6.630   1.406  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.538  -5.448   2.178  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.381  -5.658   3.052  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.224  -5.740   0.500  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.338  -7.217   2.103  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.755  -7.257   1.056  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.139  -4.205   1.865  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.660  -3.003   2.510  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.193  -2.919   2.402  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.722  -3.051   1.294  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.481  -4.078   1.104  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.230  -2.129   2.025  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.339  -3.009   3.550  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.936  -2.732   3.516  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.401  -2.697   3.498  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.057  -3.980   2.962  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.194  -3.921   2.498  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.843  -2.444   4.945  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.600  -1.887   5.633  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.459  -2.571   4.884  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.718  -1.858   2.877  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.157  -3.358   5.411  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.673  -1.736   4.990  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.587  -2.145   6.675  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.548  -0.809   5.478  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.243  -3.527   5.321  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.561  -1.958   4.940  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.364  -5.132   2.996  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.922  -6.427   2.577  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.348  -6.452   1.106  1.00  0.00           C  
+ATOM    201  O   SER A  13       8.273  -7.185   0.760  1.00  0.00           O  
+ATOM    202  CB  SER A  13       5.902  -7.544   2.812  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.513  -8.805   2.628  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.404  -5.115   3.326  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.802  -6.636   3.185  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.525  -7.475   3.814  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.073  -7.436   2.110  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.978  -8.809   1.779  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.688  -5.663   0.253  1.00  0.00           N  
+ATOM    210  CA  SER A  14       7.033  -5.491  -1.164  1.00  0.00           C  
+ATOM    211  C   SER A  14       8.036  -4.355  -1.407  1.00  0.00           C  
+ATOM    212  O   SER A  14       8.270  -3.979  -2.556  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.763  -5.217  -1.973  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.936  -6.345  -2.040  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.903  -5.135   0.612  1.00  0.00           H  
+ATOM    216  HA  SER A  14       7.475  -6.413  -1.545  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.221  -4.416  -1.508  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       6.026  -4.948  -2.995  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.164  -6.059  -2.655  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.590  -3.733  -0.358  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.577  -2.650  -0.433  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.029  -1.291  -0.893  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.565  -0.255  -0.498  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.346  -4.054   0.578  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.022  -2.519   0.554  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.370  -2.944  -1.121  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.961  -1.275  -1.702  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.253  -0.068  -2.152  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.758   0.782  -0.961  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.062   0.249  -0.094  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.114  -0.429  -3.128  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.073  -1.437  -2.599  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.058  -1.882  -3.667  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       2.925  -0.944  -3.816  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       2.827   0.118  -4.610  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.797   0.480  -5.418  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       1.736   0.848  -4.603  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.673  -2.184  -2.046  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       7.981   0.515  -2.712  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.597   0.477  -3.381  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.567  -0.849  -4.028  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.592  -2.305  -2.239  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.537  -1.022  -1.749  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.565  -1.958  -4.610  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.649  -2.842  -3.350  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       2.106  -1.187  -3.286  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.617  -0.096  -5.446  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.713   1.284  -6.011  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       0.947   0.584  -4.042  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       1.678   1.660  -5.191  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.067   2.094  -0.905  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.620   2.967   0.182  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.099   3.227   0.122  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.486   3.009  -0.928  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.427   4.260   0.005  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.667   4.322  -1.501  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.835   2.854  -1.882  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.870   2.512   1.140  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.867   5.112   0.340  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.385   4.162   0.519  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.828   4.758  -2.008  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.552   4.908  -1.749  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.456   2.680  -2.871  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.888   2.571  -1.812  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.480   3.698   1.223  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.051   4.007   1.257  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.699   5.236   0.396  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.570   6.059   0.111  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.722   4.232   2.738  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.041   4.721   3.329  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.086   3.950   2.524  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.496   3.146   0.892  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.954   4.972   2.852  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.449   3.284   3.200  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.155   5.779   3.195  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.113   4.505   4.395  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.979   4.535   2.413  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.300   2.999   3.013  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.420   5.393  -0.004  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.957   6.533  -0.802  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.749   7.823   0.014  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.677   8.899  -0.575  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.367   6.064  -1.415  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.913   5.086  -0.375  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.348   4.422   0.169  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.669   6.748  -1.599  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.038   6.889  -1.556  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.164   5.530  -2.346  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.441   5.605   0.402  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.584   4.357  -0.825  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.225   4.183   1.208  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.576   3.535  -0.421  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.622   7.704   1.342  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.537   8.783   2.335  1.00  0.00           C  
+ATOM    295  C   SER A  20       1.931   9.218   2.798  1.00  0.00           C  
+ATOM    296  O   SER A  20       2.563   8.335   3.437  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -0.247   8.262   3.545  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.531   7.207   4.069  1.00  0.00           O  
+ATOM    299  OXT SER A  20       2.277  10.398   2.599  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.701   6.779   1.733  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.039   9.654   1.908  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -0.369   9.038   4.276  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.237   7.911   3.252  1.00  0.00           H  
+ATOM    304  HG  SER A  20       1.480   7.561   3.895  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       24                                                                  
+ATOM      1  N   ASN A   1      -6.292   7.385   1.128  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.232   6.863   0.107  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.739   5.538  -0.485  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.431   4.543  -0.336  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.545   7.923  -0.975  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -6.313   8.297  -1.796  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -5.208   8.306  -1.270  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -6.440   8.526  -3.087  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.040   6.659   1.782  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.460   7.735   0.662  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.719   8.150   1.634  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.173   6.624   0.607  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.294   7.530  -1.636  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.929   8.825  -0.499  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.324   8.491  -3.570  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -5.584   8.752  -3.571  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.556   5.496  -1.115  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.032   4.330  -1.843  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.313   3.290  -0.955  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.853   2.259  -1.446  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.138   4.841  -3.003  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.722   4.651  -4.418  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.894   3.173  -4.766  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -6.050   5.386  -4.636  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.044   6.368  -1.237  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.880   3.796  -2.268  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.967   5.890  -2.853  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.179   4.327  -2.975  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.002   5.061  -5.126  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.966   2.642  -4.555  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -5.713   2.736  -4.196  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -5.117   3.069  -5.827  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -6.733   5.221  -3.804  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.855   6.450  -4.745  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -6.526   5.028  -5.550  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.243   3.530   0.360  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.536   2.698   1.337  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.999   1.230   1.340  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.180   0.335   1.524  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.688   3.329   2.730  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.527   3.057   3.667  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.504   1.888   4.455  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.478   3.993   3.769  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.449   1.665   5.360  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.422   3.773   4.671  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.410   2.617   5.478  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.592   2.435   6.380  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.647   4.393   0.678  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.476   2.708   1.078  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.781   4.391   2.610  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.613   2.981   3.190  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.302   1.165   4.368  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.485   4.893   3.169  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.435   0.773   5.967  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.377   4.493   4.774  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.371   1.780   7.044  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.291   0.971   1.083  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.855  -0.385   0.970  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.185  -1.167  -0.172  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.825  -2.331   0.000  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.390  -0.331   0.775  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.107   0.494   1.877  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.991  -1.748   0.746  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.694   1.795   1.319  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.903   1.762   0.942  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.647  -0.919   1.898  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.594   0.123  -0.197  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.901  -0.096   2.292  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.417   0.733   2.687  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.583  -2.322  -0.085  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.771  -2.267   1.681  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.072  -1.688   0.616  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.897   2.395   0.886  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.436   1.569   0.553  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.171   2.357   2.121  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.990  -0.524  -1.331  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.287  -1.099  -2.478  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.828  -1.408  -2.125  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.375  -2.526  -2.353  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.383  -0.141  -3.683  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.134  -0.729  -4.885  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.640  -0.793  -4.645  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -7.380   0.135  -4.919  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.150  -1.887  -4.116  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.215   0.461  -1.367  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.756  -2.048  -2.731  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.893   0.749  -3.368  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.380   0.134  -4.013  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.946  -0.115  -5.745  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -4.744  -1.721  -5.116  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.566  -2.656  -3.852  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -8.148  -1.839  -3.996  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.121  -0.454  -1.511  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.744  -0.663  -1.057  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.613  -1.790  -0.020  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.331  -2.579  -0.067  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.201   0.655  -0.509  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.191   0.564   0.027  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.317   0.549  -0.722  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.627   0.427   1.415  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.412   0.401   0.105  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.049   0.343   1.428  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.972   0.368   2.666  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.794   0.234   2.609  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.709   0.249   3.860  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.114   0.197   3.837  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.569   0.443  -1.359  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.136  -0.952  -1.917  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.211   1.379  -1.301  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.855   1.013   0.287  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.345   0.630  -1.800  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.387   0.366  -0.203  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.106   0.426   2.698  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.873   0.181   2.560  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.192   0.211   4.808  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.670   0.129   4.761  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.578  -1.920   0.901  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.631  -3.070   1.801  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.843  -4.394   1.050  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.191  -5.372   1.418  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.686  -2.859   2.899  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.268  -1.863   4.000  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.426  -1.718   4.994  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.023  -2.315   4.775  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.292  -1.197   0.964  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.656  -3.165   2.275  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.583  -2.492   2.437  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.886  -3.821   3.373  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.065  -0.889   3.560  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.316  -1.368   4.472  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.638  -2.679   5.461  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.167  -0.998   5.769  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.138  -3.351   5.097  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.138  -2.227   4.147  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.876  -1.684   5.651  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.657  -4.444  -0.024  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.775  -5.659  -0.860  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.440  -6.118  -1.450  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.240  -7.322  -1.591  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.774  -5.527  -2.021  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.249  -5.395  -1.620  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.167  -6.088  -2.648  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.424  -5.268  -2.953  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.590  -6.134  -3.235  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.174  -3.604  -0.275  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.108  -6.475  -0.218  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.507  -4.656  -2.587  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.662  -6.434  -2.619  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.393  -5.849  -0.659  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.497  -4.337  -1.541  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.619  -6.230  -3.559  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.435  -7.067  -2.249  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.648  -4.648  -2.106  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.213  -4.642  -3.824  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.371  -6.792  -3.971  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -8.842  -6.653  -2.403  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.385  -5.577  -3.521  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.520  -5.196  -1.760  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.824  -5.550  -2.228  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.682  -6.246  -1.149  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.738  -6.791  -1.479  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.569  -4.302  -2.729  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.926  -3.620  -3.934  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.770  -4.314  -4.963  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.694  -2.393  -3.841  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.774  -4.217  -1.668  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.732  -6.246  -3.065  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.611  -3.592  -1.925  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.563  -4.606  -3.037  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.266  -6.215   0.128  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.015  -6.734   1.274  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.595  -5.646   2.186  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.441  -5.959   3.033  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.348  -5.819   0.317  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.343  -7.348   1.874  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.832  -7.371   0.933  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.188  -4.378   2.015  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.682  -3.258   2.815  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.216  -3.151   2.773  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.797  -3.293   1.691  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.532  -4.174   1.270  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.262  -2.332   2.425  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.330  -3.391   3.837  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.904  -2.935   3.918  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.365  -2.823   3.965  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.102  -4.015   3.335  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.165  -3.833   2.746  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.736  -2.681   5.447  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.452  -2.189   6.112  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.353  -2.826   5.263  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.658  -1.915   3.438  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.038  -3.626   5.856  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.554  -1.973   5.589  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.394  -2.523   7.130  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.394  -1.103   6.036  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.102  -3.797   5.644  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.456  -2.209   5.293  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.528  -5.228   3.414  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.138  -6.446   2.859  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.295  -6.407   1.333  1.00  0.00           C  
+ATOM    201  O   SER A  13       8.174  -7.073   0.792  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.348  -7.692   3.277  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.118  -7.809   2.592  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.614  -5.292   3.842  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.138  -6.537   3.280  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.942  -8.561   3.069  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.165  -7.667   4.352  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.500  -7.079   2.847  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.489  -5.586   0.645  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.548  -5.376  -0.801  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.615  -4.354  -1.227  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.779  -4.098  -2.420  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.172  -4.906  -1.282  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.768  -5.648  -2.411  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.813  -5.042   1.173  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.781  -6.328  -1.284  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.456  -5.042  -0.494  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.202  -3.849  -1.527  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.004  -6.211  -2.103  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.309  -3.713  -0.277  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.390  -2.752  -0.512  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.950  -1.376  -1.041  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.569  -0.373  -0.689  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.111  -3.947   0.692  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.920  -2.595   0.428  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.093  -3.179  -1.226  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.896  -1.304  -1.867  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.317  -0.041  -2.355  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.801   0.839  -1.194  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.157   0.315  -0.283  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.215  -0.292  -3.405  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.119  -1.280  -2.965  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.913  -1.309  -3.915  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.266  -1.765  -5.273  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.470  -3.012  -5.684  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       4.434  -4.046  -4.877  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.742  -3.246  -6.946  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.511  -2.196  -2.163  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.125   0.496  -2.848  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.747   0.647  -3.630  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.683  -0.678  -4.311  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.544  -2.264  -2.923  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.753  -1.013  -1.976  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.174  -1.974  -3.511  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.485  -0.307  -3.974  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.286  -1.055  -5.983  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.241  -3.927  -3.896  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       4.571  -4.985  -5.203  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.784  -2.494  -7.608  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.878  -4.192  -7.246  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.021   2.169  -1.222  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.564   3.076  -0.168  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.035   3.273  -0.193  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.408   3.044  -1.232  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.304   4.392  -0.436  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.488   4.390  -1.951  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.717   2.912  -2.265  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.863   2.681   0.803  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.718   5.234  -0.121  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.279   4.364   0.050  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.611   4.759  -2.447  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.336   5.002  -2.259  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.314   2.668  -3.229  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.783   2.685  -2.219  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.420   3.714   0.924  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       2.979   3.943   0.997  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.541   5.167   0.167  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.300   6.129   0.038  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.670   4.129   2.486  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.976   4.683   3.053  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.042   3.977   2.213  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.469   3.052   0.638  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.865   4.824   2.627  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.459   3.159   2.939  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.030   5.747   2.929  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.085   4.459   4.114  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.901   4.608   2.092  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.310   3.030   2.683  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.305   5.165  -0.369  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.753   6.266  -1.151  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.318   7.409  -0.226  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.451   7.189   0.714  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.432   5.656  -1.908  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.932   4.559  -0.967  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.347   4.074  -0.285  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.493   6.630  -1.865  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.195   6.390  -2.081  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.073   5.200  -2.833  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.625   4.954  -0.249  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.416   3.748  -1.510  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.150   3.833   0.742  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.754   3.228  -0.832  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.793   8.629  -0.503  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.416   9.847   0.221  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.407  11.090  -0.662  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.891  11.013  -1.811  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.359  10.094   1.397  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.787  11.196   2.067  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.035  12.112  -0.078  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.371   8.782  -1.320  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.594   9.730   0.608  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.400   9.236   2.040  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.353  10.357   1.025  1.00  0.00           H  
+ATOM    304  HG  SER A  20       0.387  11.733   1.311  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       25                                                                  
+ATOM      1  N   ASN A   1      -8.822   3.713  -1.688  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.636   4.584  -1.839  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.387   3.720  -2.050  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.449   2.520  -1.793  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.493   5.546  -0.643  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -6.684   6.775  -1.045  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -5.471   6.716  -1.147  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.325   7.882  -1.371  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.903   3.106  -2.494  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.709   3.131  -0.870  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.662   4.268  -1.598  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.770   5.186  -2.739  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.468   5.855  -0.319  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.990   5.041   0.185  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -8.323   8.004  -1.308  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -6.719   8.647  -1.627  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.276   4.311  -2.504  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.020   3.626  -2.831  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.471   2.838  -1.629  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -2.958   1.734  -1.800  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.012   4.674  -3.361  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -2.196   4.219  -4.592  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -1.533   5.435  -5.247  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -1.091   3.204  -4.289  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.249   5.328  -2.518  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.228   2.905  -3.623  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.558   5.557  -3.630  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.343   4.981  -2.561  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -2.881   3.777  -5.315  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.296   6.145  -5.570  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -0.864   5.929  -4.541  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -0.962   5.119  -6.121  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -0.285   3.677  -3.730  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.483   2.363  -3.723  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -0.681   2.826  -5.224  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.666   3.358  -0.409  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.284   2.708   0.847  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.873   1.292   1.002  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.194   0.398   1.503  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.690   3.607   2.030  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.649   3.669   3.132  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.390   2.535   3.927  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.934   4.863   3.357  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.425   2.597   4.950  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.980   4.936   4.389  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.731   3.802   5.194  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.150   3.872   6.227  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.047   4.292  -0.362  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.198   2.613   0.856  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.852   4.601   1.660  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.632   3.256   2.454  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.935   1.619   3.761  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.110   5.742   2.747  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.221   1.739   5.572  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.449   5.867   4.548  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.326   4.786   6.461  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.115   1.071   0.535  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.776  -0.242   0.562  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.002  -1.217  -0.330  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.614  -2.289   0.122  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.263  -0.143   0.130  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.048   0.841   1.030  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.919  -1.539   0.153  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.483   1.110   0.557  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.572   1.829   0.046  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.741  -0.629   1.581  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.305   0.225  -0.896  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.090   0.432   2.021  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.535   1.802   1.049  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.419  -2.213  -0.543  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.865  -1.964   1.157  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.963  -1.481  -0.153  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.492   1.320  -0.512  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.118   0.247   0.759  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.887   1.968   1.096  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.757  -0.824  -1.585  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.017  -1.607  -2.576  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.587  -1.900  -2.083  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.148  -3.047  -2.102  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.057  -0.847  -3.919  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.071  -1.760  -5.155  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -2.773  -2.524  -5.382  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -2.723  -3.734  -5.250  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -1.697  -1.854  -5.752  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.059   0.104  -1.844  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.528  -2.564  -2.697  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.942  -0.241  -3.937  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.227  -0.144  -3.981  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.865  -2.472  -5.038  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -4.268  -1.149  -6.038  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -1.694  -0.862  -5.911  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -0.889  -2.443  -5.884  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.898  -0.878  -1.557  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.578  -0.992  -0.936  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.552  -2.023   0.205  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.292  -2.918   0.198  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.127   0.397  -0.466  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.249   0.448   0.122  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.402   0.437  -0.587  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.644   0.501   1.528  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.474   0.460   0.282  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.068   0.490   1.594  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.952   0.549   2.757  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.775   0.513   2.805  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.647   0.567   3.982  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.054   0.548   4.010  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.335   0.042  -1.580  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.127  -1.341  -1.691  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.154   1.059  -1.310  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.830   0.770   0.277  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.467   0.400  -1.665  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.459   0.466   0.011  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.127   0.579   2.747  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.854   0.502   2.796  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.097   0.607   4.913  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.578   0.569   4.955  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.488  -1.942   1.163  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.617  -2.951   2.219  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.966  -4.341   1.668  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.376  -5.320   2.123  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.642  -2.514   3.280  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.149  -1.401   4.223  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.284  -0.995   5.164  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.953  -1.839   5.080  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.154  -1.170   1.141  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.644  -3.065   2.695  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.519  -2.160   2.773  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.902  -3.381   3.888  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.860  -0.531   3.640  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.142  -0.659   4.582  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.579  -1.842   5.783  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.959  -0.178   5.809  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.180  -2.772   5.594  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.070  -1.975   4.456  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.724  -1.071   5.819  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.866  -4.444   0.675  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.232  -5.709   0.014  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.995  -6.419  -0.554  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.851  -7.626  -0.374  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.313  -5.443  -1.057  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.232  -6.637  -1.368  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -4.597  -7.726  -2.241  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.626  -8.816  -2.553  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -4.979  -9.985  -3.192  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.334  -3.588   0.376  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.648  -6.368   0.776  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.926  -4.632  -0.716  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.853  -5.080  -1.976  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.526  -7.084  -0.438  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.106  -6.251  -1.896  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -4.253  -7.289  -3.159  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -3.770  -8.185  -1.708  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.094  -9.129  -1.640  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.396  -8.398  -3.207  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -4.519  -9.702  -4.048  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -4.281 -10.374  -2.570  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -5.664 -10.700  -3.404  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -1.077  -5.668  -1.169  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.212  -6.164  -1.668  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.207  -6.590  -0.560  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.261  -7.145  -0.857  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       0.834  -5.084  -2.569  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.509  -5.695  -3.797  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.788  -5.935  -4.790  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.746  -5.888  -3.742  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.310  -4.691  -1.337  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.016  -7.046  -2.280  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.061  -4.414  -2.894  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.556  -4.497  -1.999  1.00  0.00           H  
+ATOM    170  N   GLY A  10       0.892  -6.349   0.722  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.749  -6.664   1.870  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.432  -5.442   2.495  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.341  -5.612   3.316  1.00  0.00           O  
+ATOM    174  H   GLY A  10      -0.020  -5.949   0.925  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.134  -7.131   2.639  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.517  -7.381   1.579  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.030  -4.224   2.106  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.562  -2.956   2.594  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.077  -2.849   2.377  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.519  -2.945   1.227  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.324  -4.158   1.376  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.087  -2.147   2.042  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.297  -2.847   3.642  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.898  -2.704   3.442  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.359  -2.670   3.324  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.945  -3.880   2.582  1.00  0.00           C  
+ATOM    187  O   PRO A  12       7.983  -3.757   1.936  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.900  -2.604   4.759  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.728  -2.068   5.577  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.512  -2.626   4.845  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.641  -1.759   2.794  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.189  -3.579   5.102  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.769  -1.950   4.830  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.767  -2.427   6.588  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.715  -0.978   5.530  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.264  -3.600   5.220  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.657  -1.969   5.001  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.257  -5.031   2.623  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.670  -6.282   1.972  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.824  -6.145   0.453  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.646  -6.844  -0.133  1.00  0.00           O  
+ATOM    202  CB  SER A  13       5.666  -7.410   2.245  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.190  -7.395   3.578  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.393  -5.044   3.149  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.634  -6.578   2.384  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       4.832  -7.298   1.579  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.147  -8.369   2.042  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.440  -6.757   3.610  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.065  -5.236  -0.178  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.173  -4.951  -1.616  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.384  -4.059  -1.960  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.680  -3.817  -3.128  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.873  -4.299  -2.106  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.686  -4.580  -3.476  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.428  -4.670   0.375  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.289  -5.897  -2.145  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.045  -4.689  -1.546  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.926  -3.220  -1.965  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.848  -5.193  -3.590  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.094  -3.531  -0.951  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.291  -2.699  -1.108  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.020  -1.228  -1.452  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.943  -0.418  -1.405  1.00  0.00           O  
+ATOM    224  H   GLY A  15       7.836  -3.773   0.003  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.859  -2.730  -0.178  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.916  -3.120  -1.896  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.772  -0.861  -1.777  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.352   0.518  -2.058  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.926   1.233  -0.760  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.220   0.619   0.040  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.203   0.479  -3.084  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.906   1.869  -3.663  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.859   1.824  -4.784  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.035   2.953  -5.722  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.956   3.050  -6.675  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.818   2.086  -6.908  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       6.038   4.130  -7.417  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.080  -1.599  -1.790  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.204   1.035  -2.496  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.476  -0.180  -3.886  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.302   0.068  -2.623  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.541   2.500  -2.875  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.835   2.270  -4.065  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.961   0.902  -5.323  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.862   1.868  -4.338  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.410   3.733  -5.609  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       6.760   1.254  -6.348  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       7.516   2.163  -7.627  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.407   4.899  -7.273  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.744   4.192  -8.129  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.271   2.523  -0.549  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.808   3.297   0.611  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.279   3.519   0.624  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.632   3.367  -0.415  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.573   4.626   0.537  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.901   4.777  -0.945  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.157   3.337  -1.372  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.094   2.768   1.522  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.961   5.439   0.877  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.500   4.546   1.107  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.076   5.201  -1.484  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.773   5.411  -1.109  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.927   3.208  -2.412  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.192   3.067  -1.160  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.694   3.905   1.780  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.255   4.134   1.918  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.773   5.345   1.089  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.434   6.387   1.085  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.999   4.340   3.415  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.345   4.826   3.946  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.352   4.088   3.066  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.740   3.228   1.610  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.235   5.077   3.575  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.750   3.384   3.875  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.442   5.889   3.834  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.476   4.586   5.001  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.245   4.671   2.949  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.572   3.112   3.500  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.634   5.227   0.378  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.081   6.286  -0.462  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.140   7.224   0.318  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.995   6.854   0.627  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.343   5.530  -1.568  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.205   4.301  -0.835  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.881   3.994   0.190  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.884   6.872  -0.910  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.453   6.123  -1.976  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       1.059   5.213  -2.327  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.137   4.524  -0.353  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.362   3.458  -1.502  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.439   3.685   1.117  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.543   3.227  -0.214  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.592   8.464   0.558  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.080   9.471   1.411  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.300   8.997   2.863  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.168   9.604   3.527  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.392   9.955   0.771  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.109  10.475  -0.508  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.428   8.079   3.303  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.561   8.632   0.336  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.570  10.339   1.493  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.075   9.132   0.683  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.847  10.731   1.390  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.488   9.864  -0.909  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       26                                                                  
+ATOM      1  N   ASN A   1      -6.391   7.510   1.067  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.401   6.806   0.244  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.844   5.505  -0.338  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.312   4.446   0.047  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.052   7.731  -0.811  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.488   7.309  -1.115  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.112   6.606  -0.339  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.066   7.738  -2.223  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.984   6.869   1.737  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.657   7.891   0.486  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.829   8.267   1.573  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.203   6.494   0.918  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.056   8.737  -0.438  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.467   7.735  -1.732  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.621   8.342  -2.895  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.024   7.438  -2.329  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.809   5.545  -1.190  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.260   4.361  -1.876  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.455   3.379  -0.984  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.894   2.406  -1.484  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.436   4.848  -3.091  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.581   3.949  -4.337  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -5.961   4.101  -4.990  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.517   4.307  -5.376  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.432   6.430  -1.495  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -6.112   3.787  -2.244  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.762   5.838  -3.347  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.385   4.897  -2.803  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.439   2.910  -4.055  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -6.748   3.783  -4.309  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -6.130   5.140  -5.275  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -6.013   3.478  -5.884  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.640   5.340  -5.703  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -2.523   4.177  -4.947  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.611   3.645  -6.237  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.393   3.603   0.335  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.609   2.805   1.286  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.980   1.311   1.271  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.097   0.457   1.342  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.768   3.413   2.688  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.733   2.956   3.700  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.416   3.452   3.615  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -3.089   2.094   4.759  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.459   3.085   4.578  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -2.137   1.743   5.737  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.818   2.240   5.645  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.102   1.933   6.600  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.931   4.374   0.692  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.558   2.880   1.004  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.700   4.480   2.599  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.769   3.193   3.064  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.140   4.153   2.841  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -4.101   1.723   4.839  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.543   3.484   4.536  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -2.415   1.104   6.560  1.00  0.00           H  
+ATOM     56  HH  TYR A   3      -0.304   1.658   7.423  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.271   0.979   1.105  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.754  -0.410   1.022  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.089  -1.175  -0.139  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.712  -2.334   0.030  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.299  -0.466   0.907  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.026   0.325   2.026  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.790  -1.925   0.951  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.616   1.639   1.507  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.941   1.734   1.048  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.466  -0.915   1.945  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.586  -0.056  -0.062  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.820  -0.280   2.419  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.342   0.536   2.850  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.387  -2.483   0.107  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.482  -2.388   1.890  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.878  -1.947   0.874  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.815   2.287   1.164  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.304   1.440   0.682  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.164   2.137   2.308  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.926  -0.531  -1.304  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.245  -1.108  -2.469  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.765  -1.396  -2.181  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.271  -2.461  -2.542  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.387  -0.170  -3.681  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.621  -0.468  -4.541  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.458  -1.776  -5.310  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.686  -1.876  -6.248  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.163  -2.827  -4.942  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.175   0.448  -1.343  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.705  -2.066  -2.705  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.457   0.839  -3.324  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.501  -0.243  -4.314  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.481  -0.542  -3.904  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.740   0.337  -5.267  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.842  -2.805  -4.203  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.976  -3.641  -5.504  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.070  -0.489  -1.486  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.694  -0.725  -1.048  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.586  -1.880  -0.041  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.293  -2.734  -0.172  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.120   0.575  -0.487  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.275   0.460   0.036  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.391   0.368  -0.723  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.722   0.382   1.424  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.492   0.238   0.099  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.144   0.266   1.428  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.079   0.400   2.681  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.896   0.202   2.607  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.824   0.321   3.875  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.227   0.234   3.842  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.540   0.365  -1.212  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.096  -1.008  -1.916  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.125   1.309  -1.269  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.758   0.938   0.318  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.415   0.380  -1.804  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.461   0.154  -0.221  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6       0.002   0.485   2.724  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.971   0.113   2.553  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.315   0.339   4.828  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.787   0.188   4.764  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.509  -1.961   0.928  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.576  -3.104   1.842  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.846  -4.428   1.109  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.246  -5.436   1.477  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.635  -2.881   2.933  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.340  -1.734   3.917  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.514  -1.637   4.896  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.050  -1.947   4.717  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.179  -1.199   1.017  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.602  -3.218   2.316  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.569  -2.670   2.449  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.724  -3.804   3.508  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.258  -0.794   3.378  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.444  -1.501   4.345  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.577  -2.544   5.497  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.373  -0.786   5.557  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.082  -2.901   5.242  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.188  -1.932   4.050  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.929  -1.141   5.440  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.690  -4.435   0.061  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.971  -5.620  -0.774  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.703  -6.283  -1.322  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.660  -7.507  -1.400  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.900  -5.260  -1.954  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.270  -5.950  -1.934  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.299  -5.296  -1.003  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.225  -5.825   0.432  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.472  -5.522   1.173  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.165  -3.561  -0.155  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.442  -6.380  -0.153  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.061  -4.199  -1.939  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.414  -5.561  -2.885  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.666  -5.938  -2.931  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.158  -7.008  -1.693  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.123  -4.238  -0.987  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -7.289  -5.514  -1.408  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.080  -6.888   0.407  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -5.360  -5.380   0.933  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.622  -4.522   1.214  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -8.262  -5.946   0.705  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.423  -5.889   2.114  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.697  -5.489  -1.696  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.578  -5.995  -2.210  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.430  -6.676  -1.116  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.217  -7.569  -1.419  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.320  -4.822  -2.871  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.419  -5.299  -3.819  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.520  -5.598  -3.301  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.157  -5.333  -5.040  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.826  -4.488  -1.630  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.373  -6.742  -2.979  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.614  -4.235  -3.427  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.750  -4.177  -2.102  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.241  -6.295   0.157  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.072  -6.717   1.292  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.600  -5.567   2.160  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.329  -5.819   3.122  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.439  -5.705   0.348  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.481  -7.376   1.928  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.933  -7.279   0.931  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.242  -4.309   1.862  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.640  -3.145   2.653  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.171  -3.021   2.779  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.857  -3.010   1.755  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.703  -4.147   1.019  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.262  -2.248   2.167  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.174  -3.222   3.633  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.750  -2.936   3.998  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.203  -2.848   4.176  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.986  -3.997   3.521  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.127  -3.802   3.103  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.446  -2.831   5.690  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.113  -2.378   6.278  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.086  -2.931   5.293  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.548  -1.905   3.749  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.705  -3.810   6.045  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.253  -2.148   5.957  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       4.966  -2.790   7.258  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.066  -1.289   6.283  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.799  -3.927   5.571  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.196  -2.303   5.294  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.377  -5.184   3.397  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.999  -6.365   2.789  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.090  -6.294   1.255  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.691  -7.181   0.653  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.253  -7.630   3.234  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.246  -7.721   4.648  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.417  -5.288   3.715  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.023  -6.439   3.156  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.242  -7.590   2.876  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.749  -8.510   2.826  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.152  -7.694   4.967  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.547  -5.244   0.623  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.546  -5.037  -0.834  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.710  -4.195  -1.366  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.806  -3.980  -2.574  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.255  -4.326  -1.232  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.168  -5.191  -1.045  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.016  -4.575   1.174  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.572  -6.003  -1.341  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.126  -3.452  -0.623  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.295  -4.054  -2.288  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.879  -5.451  -2.001  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.565  -3.636  -0.501  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.674  -2.757  -0.898  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.253  -1.339  -1.324  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.969  -0.382  -1.033  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.424  -3.831   0.482  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.376  -2.674  -0.069  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.203  -3.214  -1.736  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.102  -1.178  -1.996  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.531   0.125  -2.365  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.961   0.857  -1.128  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.215   0.232  -0.372  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.442  -0.081  -3.437  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.971   1.260  -4.018  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.982   1.094  -5.178  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.802   2.367  -5.907  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.658   2.919  -6.763  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.787   2.331  -7.088  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.400   4.083  -7.311  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.619  -2.035  -2.253  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.340   0.714  -2.794  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.841  -0.685  -4.229  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.593  -0.617  -3.009  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.493   1.822  -3.239  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.844   1.801  -4.375  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.357   0.352  -5.856  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.021   0.765  -4.779  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.960   2.882  -5.711  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       6.987   1.438  -6.674  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       7.437   2.753  -7.728  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.551   4.572  -7.091  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.056   4.492  -7.951  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.229   2.166  -0.931  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.645   2.952   0.164  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.124   3.174   0.002  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.593   2.997  -1.099  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.407   4.284   0.146  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.816   4.441  -1.315  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.118   3.003  -1.727  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.829   2.440   1.109  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.773   5.093   0.456  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.301   4.200   0.766  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.016   4.853  -1.900  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.685   5.087  -1.430  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.923   2.865  -2.773  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.154   2.758  -1.485  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.413   3.584   1.073  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       2.970   3.822   1.030  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.594   5.069   0.201  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.394   5.998   0.089  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.538   3.970   2.492  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.794   4.489   3.188  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       4.918   3.789   2.425  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.489   2.946   0.603  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.732   4.672   2.584  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.286   2.991   2.895  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.872   5.555   3.099  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.805   4.232   4.248  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.797   4.405   2.406  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.127   2.823   2.884  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.367   5.119  -0.360  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.902   6.218  -1.210  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.393   7.441  -0.434  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.376   8.539  -0.986  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.244   5.614  -2.031  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.838   4.567  -1.088  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.396   4.036  -0.365  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.700   6.542  -1.881  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.972   6.361  -2.283  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.161   5.121  -2.915  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.529   5.013  -0.399  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.356   3.777  -1.634  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.146   3.757   0.640  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.819   3.209  -0.930  1.00  0.00           H  
+ATOM    293  N   SER A  20      -0.071   7.250   0.808  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.627   8.275   1.694  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.615   7.810   3.147  1.00  0.00           C  
+ATOM    296  O   SER A  20      -0.310   6.619   3.378  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -2.071   8.593   1.302  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.519   9.564   2.220  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.045   8.668   3.958  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.027   6.343   1.249  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.028   9.183   1.627  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.109   8.980   0.302  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -2.678   7.692   1.404  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.976   9.352   3.052  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       27                                                                  
+ATOM      1  N   ASN A   1      -6.891   7.053   0.882  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.783   6.096   0.185  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.000   4.934  -0.439  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.252   3.795  -0.069  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.741   6.795  -0.802  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.186   6.423  -0.481  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.742   5.509  -1.060  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.818   7.078   0.477  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.270   6.561   1.512  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.341   7.576   0.215  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.442   7.704   1.424  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.409   5.625   0.947  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.621   7.858  -0.720  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.526   6.488  -1.827  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.460   7.874   0.978  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.767   6.760   0.616  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.006   5.194  -1.304  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.176   4.163  -1.955  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.381   3.236  -1.006  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.851   2.217  -1.451  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.228   4.849  -2.968  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.572   4.553  -4.446  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.888   5.843  -5.207  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -3.420   3.823  -5.139  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.840   6.139  -1.619  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.853   3.499  -2.494  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.280   5.910  -2.815  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.207   4.517  -2.778  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.453   3.919  -4.507  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.757   6.328  -4.763  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.034   6.520  -5.172  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -5.113   5.608  -6.248  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.521   4.441  -5.130  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -3.217   2.884  -4.623  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.691   3.600  -6.170  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.322   3.538   0.295  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.630   2.739   1.309  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.063   1.261   1.312  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.226   0.377   1.478  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.838   3.395   2.684  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.746   3.070   3.682  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.555   3.822   3.668  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -2.916   2.041   4.628  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.528   3.543   4.588  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -1.889   1.757   5.549  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.690   2.503   5.526  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.302   2.210   6.407  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.782   4.379   0.596  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.564   2.767   1.081  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.870   4.459   2.551  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.808   3.100   3.087  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.427   4.632   2.963  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -3.834   1.470   4.653  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.367   4.148   4.584  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -1.998   0.980   6.291  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.068   2.771   6.272  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.351   0.975   1.056  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.888  -0.395   0.981  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.258  -1.202  -0.170  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -5.000  -2.397  -0.010  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.431  -0.365   0.840  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.123   0.422   1.988  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.009  -1.791   0.799  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.974   1.614   1.515  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.981   1.754   0.908  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.641  -0.909   1.910  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.663   0.104  -0.117  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.761  -0.255   2.523  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.383   0.790   2.700  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.689  -2.299  -0.111  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.678  -2.350   1.677  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.099  -1.748   0.791  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.549   2.540   1.901  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.023   1.674   0.427  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.990   1.511   1.898  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.008  -0.559  -1.320  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.326  -1.156  -2.473  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.853  -1.433  -2.147  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.377  -2.543  -2.369  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.472  -0.240  -3.703  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.830  -0.425  -4.399  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.178   0.770  -5.279  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.720   0.909  -6.400  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.002   1.685  -4.804  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.155   0.443  -1.336  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.787  -2.118  -2.705  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.380   0.781  -3.387  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.684  -0.462  -4.425  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.791  -1.307  -5.009  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.617  -0.559  -3.656  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.431   1.614  -3.898  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.199   2.423  -5.458  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.147  -0.465  -1.550  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.764  -0.655  -1.100  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.620  -1.767  -0.046  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.292  -2.590  -0.131  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.223   0.670  -0.570  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.164   0.588  -0.013  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.300   0.553  -0.745  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.583   0.484   1.384  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.385   0.445   0.101  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.006   0.404   1.417  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.917   0.446   2.628  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.739   0.321   2.605  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.641   0.345   3.833  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.047   0.297   3.825  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.601   0.431  -1.402  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.156  -0.955  -1.957  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.221   1.379  -1.376  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.886   1.043   0.211  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.343   0.604  -1.827  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.363   0.430  -0.184  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.163   0.502   2.652  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.818   0.270   2.567  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.113   0.309   4.774  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.594   0.239   4.756  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.538  -1.844   0.927  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.586  -2.971   1.862  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.803  -4.308   1.137  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.174  -5.298   1.515  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.666  -2.743   2.930  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.317  -1.692   4.002  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.510  -1.571   4.957  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.074  -2.069   4.817  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.228  -1.098   1.006  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.615  -3.051   2.349  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.562  -2.425   2.433  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.847  -3.693   3.438  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.144  -0.726   3.537  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.393  -1.251   4.403  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.709  -2.532   5.432  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.298  -0.838   5.731  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.167  -3.087   5.199  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.183  -1.995   4.196  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.956  -1.382   5.655  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.624  -4.342   0.073  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.837  -5.530  -0.770  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.539  -6.072  -1.384  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.398  -7.286  -1.490  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.851  -5.224  -1.892  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.867  -6.357  -2.133  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.241  -6.033  -1.528  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.193  -5.982   0.004  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.398  -5.322   0.557  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.095  -3.479  -0.180  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.224  -6.323  -0.132  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.391  -4.335  -1.628  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.307  -5.048  -2.822  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.979  -6.503  -3.190  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -4.495  -7.304  -1.740  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.567  -5.079  -1.897  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.954  -6.797  -1.840  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.136  -6.983   0.386  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -5.303  -5.427   0.313  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.411  -4.352   0.270  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -8.235  -5.778   0.219  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.387  -5.360   1.567  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.586  -5.196  -1.733  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.742  -5.596  -2.224  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.596  -6.294  -1.144  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.602  -6.919  -1.489  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.544  -4.384  -2.750  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.978  -3.644  -3.968  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.247  -4.280  -4.760  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.381  -2.472  -4.162  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.811  -4.209  -1.663  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.611  -6.302  -3.046  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.620  -3.675  -1.948  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.528  -4.743  -3.048  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.242  -6.171   0.145  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.030  -6.642   1.290  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.603  -5.520   2.168  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.419  -5.803   3.047  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.348  -5.733   0.351  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.391  -7.260   1.920  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.859  -7.262   0.950  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.213  -4.255   1.949  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.700  -3.121   2.734  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.238  -3.008   2.707  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.830  -3.106   1.626  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.566  -4.066   1.192  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.278  -2.203   2.330  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.340  -3.242   3.755  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.916  -2.815   3.863  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.378  -2.719   3.922  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.104  -3.938   3.329  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.203  -3.799   2.793  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.739  -2.555   5.405  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.447  -2.080   6.062  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.360  -2.729   5.208  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.689  -1.827   3.377  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.056  -3.491   5.824  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.544  -1.832   5.542  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.388  -2.415   7.080  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.375  -0.995   5.986  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.126  -3.708   5.580  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.453  -2.129   5.244  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.487  -5.126   3.383  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.062  -6.391   2.910  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.106  -6.523   1.380  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.528  -7.564   0.882  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.294  -7.570   3.525  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.273  -7.463   4.938  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.554  -5.180   3.780  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.093  -6.447   3.259  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.287  -7.567   3.155  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.781  -8.506   3.247  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.175  -7.487   5.266  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.699  -5.485   0.633  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.610  -5.482  -0.834  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.584  -4.502  -1.514  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.442  -4.206  -2.702  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.155  -5.226  -1.232  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.800  -6.039  -2.327  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.332  -4.681   1.131  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.872  -6.476  -1.198  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.515  -5.452  -0.401  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.998  -4.181  -1.482  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.937  -6.470  -2.076  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.565  -3.977  -0.761  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.672  -3.163  -1.282  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.268  -1.785  -1.820  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.964  -1.240  -2.674  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.599  -4.262   0.210  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.403  -3.009  -0.487  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.168  -3.709  -2.087  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.140  -1.233  -1.349  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.498  -0.025  -1.884  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.929   0.860  -0.758  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.271   0.329   0.139  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.407  -0.441  -2.895  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.361  -1.404  -2.301  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.279  -1.827  -3.291  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.779  -2.819  -4.260  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.349  -2.952  -5.509  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.327  -2.269  -5.969  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.939  -3.800  -6.319  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.655  -1.742  -0.622  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.255   0.540  -2.429  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.902   0.443  -3.234  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.890  -0.927  -3.745  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.869  -2.285  -1.958  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.860  -0.926  -1.472  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.459  -2.256  -2.747  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.903  -0.939  -3.800  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.524  -3.428  -3.947  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.617  -2.056  -5.244  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.019  -2.337  -6.918  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.659  -4.401  -5.958  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.587  -3.922  -7.250  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.128   2.192  -0.787  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.585   3.097   0.228  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.060   3.276   0.076  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.523   3.016  -1.003  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.327   4.419   0.005  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.594   4.418  -1.499  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.848   2.945  -1.807  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.811   2.711   1.221  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.717   5.255   0.287  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.275   4.397   0.543  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.743   4.783  -2.041  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.452   5.039  -1.758  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.478   2.699  -2.783  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.915   2.731  -1.732  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.352   3.730   1.131  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       2.910   3.955   1.082  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.524   5.163   0.203  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.330   6.074   0.016  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.481   4.156   2.540  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       3.734   4.715   3.207  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       4.864   4.002   2.467  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.431   3.060   0.690  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.667   4.852   2.608  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.235   3.190   2.981  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       3.798   5.778   3.077  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       3.753   4.504   4.277  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.732   4.631   2.414  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.090   3.058   2.966  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.275   5.206  -0.306  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.771   6.284  -1.164  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.330   7.537  -0.389  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.160   8.598  -0.988  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.429   5.664  -1.889  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.979   4.669  -0.864  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.284   4.149  -0.189  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.528   6.574  -1.894  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.160   6.411  -2.131  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.083   5.121  -2.771  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.622   5.157  -0.157  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.531   3.860  -1.339  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.091   3.933   0.844  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.650   3.279  -0.729  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.116   7.403   0.925  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.336   8.429   1.868  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.288   8.158   3.235  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.091   8.990   3.697  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.868   8.401   1.974  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.214   7.177   2.590  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.112   7.093   3.776  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.272   6.489   1.323  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.007   9.414   1.535  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.212   9.224   2.570  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -2.324   8.479   0.986  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.394   7.015   3.184  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       28                                                                  
+ATOM      1  N   ASN A   1      -4.637   8.314   0.281  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -5.414   7.451  -0.654  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -4.552   6.258  -1.103  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -3.410   6.182  -0.671  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -5.986   8.274  -1.830  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.060   7.510  -2.606  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -7.598   6.525  -2.122  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.361   7.888  -3.833  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -4.274   7.750   1.038  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -3.845   8.730  -0.193  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -5.220   9.048   0.659  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -6.264   7.034  -0.107  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -6.417   9.177  -1.442  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -5.178   8.555  -2.505  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -6.930   8.673  -4.294  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -8.069   7.331  -4.288  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.081   5.309  -1.895  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.421   4.095  -2.428  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.907   3.086  -1.373  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.438   2.004  -1.727  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.323   4.462  -3.461  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.852   4.852  -4.858  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.240   6.330  -4.955  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.790   4.587  -5.929  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.060   5.437  -2.149  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.183   3.538  -2.975  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -2.763   5.291  -3.073  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.689   3.583  -3.592  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.724   4.242  -5.093  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.010   6.557  -4.229  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.370   6.961  -4.774  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.633   6.540  -5.950  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.903   5.190  -5.739  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -2.517   3.530  -5.926  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.189   4.833  -6.912  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.044   3.394  -0.080  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.489   2.632   1.037  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.961   1.172   1.078  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.161   0.277   1.338  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.815   3.362   2.349  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.670   3.331   3.335  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.480   2.213   4.167  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.776   4.416   3.400  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.407   2.188   5.077  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.707   4.403   4.312  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.523   3.285   5.158  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.472   3.267   6.085  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.369   4.327   0.113  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.405   2.622   0.917  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.046   4.385   2.124  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.703   2.925   2.808  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.164   1.380   4.111  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.914   5.270   2.750  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.257   1.345   5.732  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.031   5.245   4.351  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.616   4.135   6.463  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.240   0.915   0.764  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.800  -0.440   0.662  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.054  -1.256  -0.409  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.725  -2.421  -0.194  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.321  -0.381   0.365  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.099   0.508   1.368  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.932  -1.793   0.371  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.620   1.792   0.710  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.837   1.705   0.575  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.656  -0.946   1.618  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.455   0.022  -0.641  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.933  -0.049   1.751  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.469   0.772   2.219  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.495  -2.396  -0.421  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.751  -2.278   1.331  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.007  -1.735   0.196  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.790   2.390   0.335  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.288   1.538  -0.114  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.178   2.375   1.445  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.758  -0.632  -1.557  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.009  -1.246  -2.650  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.556  -1.532  -2.257  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.056  -2.621  -2.522  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.126  -0.385  -3.921  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.525  -1.255  -5.121  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.816  -0.407  -6.354  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.867   0.201  -6.470  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.916  -0.347  -7.314  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -4.955   0.358  -1.625  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.460  -2.209  -2.849  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.872   0.371  -3.769  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.180   0.117  -4.130  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.722  -1.931  -5.344  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.434  -1.805  -4.876  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -3.043  -0.844  -7.271  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -4.190   0.218  -8.099  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.905  -0.591  -1.563  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.573  -0.794  -0.989  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.539  -1.937   0.047  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.365  -2.772   0.016  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.090   0.537  -0.404  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.273   0.496   0.209  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.441   0.483  -0.473  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.630   0.425   1.623  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.492   0.396   0.418  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.053   0.371   1.722  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.899   0.398   2.830  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.719   0.302   2.954  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.557   0.314   4.072  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.961   0.267   4.137  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.385   0.292  -1.412  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.108  -1.080  -1.790  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.079   1.264  -1.193  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.793   0.874   0.356  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.536   0.516  -1.550  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.475   0.350   0.133  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.179   0.447   2.791  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.797   0.257   2.979  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.979   0.296   4.987  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.455   0.210   5.097  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.539  -2.023   0.936  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.647  -3.114   1.911  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.880  -4.491   1.263  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.299  -5.464   1.739  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.744  -2.801   2.945  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.387  -1.679   3.942  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.618  -1.346   4.787  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.248  -2.065   4.893  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.229  -1.275   0.955  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.693  -3.194   2.432  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.630  -2.508   2.415  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.953  -3.706   3.517  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.088  -0.784   3.401  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.425  -0.996   4.140  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.951  -2.230   5.330  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.378  -0.561   5.504  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.499  -2.980   5.429  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.325  -2.214   4.336  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.082  -1.265   5.612  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.664  -4.593   0.174  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.892  -5.859  -0.562  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.591  -6.528  -1.022  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.477  -7.746  -0.936  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.818  -5.628  -1.769  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.295  -5.486  -1.357  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.116  -4.646  -2.351  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.882  -5.452  -3.401  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.477  -4.544  -4.411  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.145  -3.750  -0.132  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.367  -6.574   0.111  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.512  -4.730  -2.271  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.736  -6.467  -2.462  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.729  -6.465  -1.296  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.344  -4.993  -0.387  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.826  -4.068  -1.791  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.454  -3.961  -2.867  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.208  -6.131  -3.888  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.667  -6.022  -2.896  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.054  -3.846  -3.961  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.746  -4.071  -4.926  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.047  -5.062  -5.068  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.606  -5.739  -1.457  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.739  -6.198  -1.825  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.651  -6.499  -0.611  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.838  -6.780  -0.797  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.370  -5.155  -2.771  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.177  -5.531  -4.240  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.135  -5.136  -4.811  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.077  -6.215  -4.775  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.801  -4.748  -1.533  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.652  -7.136  -2.376  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.911  -4.202  -2.593  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.441  -5.088  -2.597  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.167  -6.398   0.637  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.944  -6.694   1.851  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.520  -5.474   2.584  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.356  -5.650   3.475  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.189  -6.147   0.762  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.294  -7.220   2.549  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.770  -7.362   1.607  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.100  -4.254   2.229  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.528  -2.992   2.832  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.060  -2.837   2.922  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.712  -2.686   1.888  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.508  -4.184   1.407  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.150  -2.182   2.211  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.067  -2.896   3.812  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.678  -2.872   4.125  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.137  -2.792   4.262  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.903  -3.861   3.466  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.043  -3.629   3.069  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.429  -2.936   5.761  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.120  -2.531   6.433  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.058  -2.991   5.436  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.463  -1.808   3.926  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.685  -3.949   6.004  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.254  -2.292   6.069  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.002  -3.028   7.377  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.080  -1.447   6.534  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.779  -4.009   5.628  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.172  -2.363   5.530  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.278  -5.017   3.209  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.884  -6.142   2.489  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.737  -6.043   0.960  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.147  -6.960   0.254  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.306  -7.461   3.021  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.621  -7.599   4.395  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.320  -5.131   3.531  1.00  0.00           H  
+ATOM    205  HA  SER A  13       7.953  -6.155   2.698  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.240  -7.459   2.898  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.742  -8.301   2.479  1.00  0.00           H  
+ATOM    208  HG  SER A  13       5.808  -7.714   4.892  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.176  -4.942   0.434  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.884  -4.748  -0.996  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.004  -4.076  -1.802  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.860  -3.890  -3.006  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.636  -3.874  -1.140  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.598  -4.383  -0.343  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.795  -4.245   1.069  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.675  -5.716  -1.456  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.865  -2.873  -0.828  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.320  -3.854  -2.182  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.437  -5.331  -0.578  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.091  -3.636  -1.156  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.222  -2.961  -1.807  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.979  -1.499  -2.225  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.937  -0.811  -2.570  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.136  -3.819  -0.163  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.080  -2.981  -1.136  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.494  -3.517  -2.706  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.733  -1.005  -2.166  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.340   0.378  -2.469  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.864   1.090  -1.189  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.138   0.469  -0.408  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.242   0.351  -3.552  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.909   1.749  -4.102  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.828   1.696  -5.186  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.677   3.011  -5.838  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.080   3.264  -6.997  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.453   2.326  -7.670  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.108   4.474  -7.504  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.011  -1.654  -1.889  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.211   0.896  -2.870  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.577  -0.266  -4.364  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.337  -0.100  -3.141  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.561   2.365  -3.295  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.814   2.176  -4.534  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.104   0.967  -5.923  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.881   1.398  -4.732  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.099   3.795  -5.368  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.423   1.404  -7.274  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.006   2.520  -8.548  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.586   5.218  -7.026  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.669   4.656  -8.390  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.209   2.375  -0.963  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.738   3.134   0.201  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.208   3.346   0.203  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.576   3.259  -0.855  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.490   4.471   0.149  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.846   4.634  -1.326  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.110   3.196  -1.761  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.021   2.596   1.106  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.862   5.275   0.482  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.407   4.394   0.736  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.031   5.063  -1.877  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.720   5.268  -1.469  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.900   3.076  -2.806  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.141   2.925  -1.531  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.607   3.648   1.372  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.168   3.868   1.495  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.728   5.176   0.813  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.421   6.189   0.932  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.880   3.905   2.999  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.202   4.357   3.615  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.252   3.767   2.674  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.650   3.021   1.056  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.097   4.604   3.221  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.640   2.905   3.351  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.268   5.428   3.640  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.322   3.987   4.633  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.103   4.418   2.610  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.544   2.776   3.024  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.566   5.189   0.135  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.986   6.406  -0.419  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.340   7.243   0.694  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.310   6.698   1.588  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.045   5.908  -1.435  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.542   4.596  -0.823  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.688   4.050  -0.100  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.751   6.996  -0.927  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.849   6.611  -1.542  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.455   5.698  -2.382  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.344   4.774  -0.133  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.898   3.904  -1.584  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.402   3.603   0.833  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.199   3.327  -0.734  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.480   8.571   0.624  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.125   9.511   1.572  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.770  10.671   0.820  1.00  0.00           C  
+ATOM    296  O   SER A  20      -2.016  10.756   0.905  1.00  0.00           O  
+ATOM    297  CB  SER A  20       0.919   9.961   2.597  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.248  10.488   3.720  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.011  11.405   0.152  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.013   8.983  -0.129  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.928   9.009   2.110  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.519   9.122   2.895  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.582  10.712   2.159  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.420  11.104   3.405  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       29                                                                  
+ATOM      1  N   ASN A   1      -8.605   5.735  -1.508  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.571   6.051  -0.495  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.164   5.538  -0.832  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -5.240   5.940  -0.139  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.006   5.614   0.920  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.446   6.833   1.721  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -7.636   7.667   2.079  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -9.727   7.012   1.978  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -8.317   6.060  -2.422  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -8.771   4.738  -1.536  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.471   6.197  -1.263  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.456   7.138  -0.461  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.823   4.923   0.844  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.168   5.160   1.453  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.461   6.361   1.754  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -9.905   7.847   2.515  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.966   4.679  -1.852  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.666   4.117  -2.283  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.002   3.168  -1.262  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.524   2.099  -1.642  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.717   5.253  -2.748  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.317   5.246  -4.235  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -2.553   3.980  -4.653  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.536   5.478  -5.132  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.737   4.358  -2.414  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.871   3.489  -3.150  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.203   6.188  -2.545  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.806   5.212  -2.162  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -2.646   6.094  -4.387  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -1.523   4.249  -4.893  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.534   3.243  -3.853  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.005   3.530  -5.537  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -5.218   4.631  -5.088  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.054   6.385  -4.819  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.203   5.612  -6.162  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.025   3.502   0.030  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.458   2.724   1.133  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.964   1.270   1.170  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.186   0.358   1.441  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.738   3.456   2.457  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.570   3.419   3.420  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.245   2.219   4.078  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.797   4.577   3.646  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.149   2.170   4.960  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.713   4.539   4.544  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.388   3.333   5.204  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.627   3.280   6.107  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.367   4.438   0.237  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.377   2.691   0.989  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.966   4.481   2.238  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.614   3.021   2.941  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.836   1.333   3.908  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.032   5.503   3.135  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.891   1.259   5.474  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.128   5.433   4.713  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.617   4.042   6.689  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.244   1.037   0.838  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.834  -0.306   0.713  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.105  -1.123  -0.367  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.724  -2.268  -0.130  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.352  -0.235   0.407  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.137   0.689   1.373  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.972  -1.643   0.457  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.547   2.007   0.707  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.819   1.844   0.651  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.700  -0.825   1.663  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.482   0.137  -0.611  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.022   0.177   1.699  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.548   0.901   2.265  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.504  -2.298  -0.279  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.845  -2.074   1.451  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.037  -1.590   0.226  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.664   2.587   0.439  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.134   1.802  -0.191  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.164   2.579   1.400  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.897  -0.530  -1.550  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.198  -1.155  -2.673  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.723  -1.419  -2.333  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.200  -2.473  -2.684  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.336  -0.262  -3.917  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -3.914  -0.964  -5.221  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.086  -1.137  -6.184  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.679  -0.180  -6.653  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.471  -2.356  -6.511  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.132   0.448  -1.635  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.672  -2.115  -2.879  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.362   0.038  -4.009  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.724   0.632  -3.790  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.155  -0.376  -5.701  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -3.469  -1.937  -5.010  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.984  -3.177  -6.199  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.221  -2.372  -7.181  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.071  -0.497  -1.615  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.715  -0.699  -1.098  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.639  -1.865  -0.097  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.196  -2.757  -0.250  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.203   0.608  -0.484  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.201   0.530   0.024  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.311   0.523  -0.750  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.672   0.404   1.403  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.428   0.392   0.050  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.094   0.319   1.381  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.048   0.358   2.668  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.864   0.210   2.546  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.810   0.242   3.848  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.214   0.174   3.791  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.559   0.372  -1.412  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.064  -0.958  -1.933  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.249   1.374  -1.234  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.852   0.901   0.340  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.315   0.589  -1.829  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.395   0.361  -0.282  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.028   0.427   2.725  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.940   0.156   2.473  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.316   0.221   4.810  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.792   0.099   4.701  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.536  -1.900   0.899  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.617  -3.007   1.855  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.901  -4.357   1.181  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.360  -5.362   1.635  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.675  -2.710   2.932  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.221  -1.687   3.991  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.385  -1.386   4.937  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.031  -2.194   4.815  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.191  -1.126   0.991  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.645  -3.114   2.334  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.552  -2.327   2.447  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.922  -3.640   3.447  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.930  -0.760   3.500  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.245  -1.036   4.365  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.661  -2.286   5.488  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.096  -0.608   5.644  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.172  -3.243   5.075  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.114  -2.086   4.240  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.929  -1.613   5.731  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.692  -4.379   0.094  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.020  -5.583  -0.687  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.785  -6.364  -1.155  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.838  -7.588  -1.203  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.879  -5.189  -1.903  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.659  -6.371  -2.495  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.247  -6.001  -3.867  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.373  -6.957  -4.272  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.632  -6.645  -3.554  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.148  -3.504  -0.155  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.595  -6.254  -0.047  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.579  -4.436  -1.597  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.229  -4.772  -2.673  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -3.997  -7.208  -2.609  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.454  -6.641  -1.801  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.637  -5.002  -3.821  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -4.447  -6.061  -4.607  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.542  -6.870  -5.328  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.057  -7.983  -4.060  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.483  -6.699  -2.554  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.939  -5.708  -3.782  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.360  -7.298  -3.811  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.706  -5.663  -1.517  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.544  -6.266  -1.987  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.293  -6.977  -0.843  1.00  0.00           C  
+ATOM    161  O   ASP A   9       1.650  -8.148  -0.961  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.392  -5.171  -2.653  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.434  -5.757  -3.608  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.525  -6.132  -3.128  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.117  -5.814  -4.817  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.755  -4.653  -1.452  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.304  -7.017  -2.743  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.744  -4.518  -3.205  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.878  -4.560  -1.892  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.469  -6.281   0.289  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.142  -6.803   1.484  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.644  -5.740   2.469  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.613  -5.985   3.194  1.00  0.00           O  
+ATOM    174  H   GLY A  10       1.155  -5.323   0.250  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.445  -7.452   2.016  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.995  -7.408   1.175  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.028  -4.548   2.496  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.465  -3.422   3.328  1.00  0.00           C  
+ATOM    179  C   GLY A  11       3.961  -3.104   3.147  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.428  -3.060   2.005  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.229  -4.418   1.894  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.897  -2.535   3.047  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.242  -3.663   4.366  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.744  -2.895   4.229  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.184  -2.626   4.136  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.990  -3.695   3.379  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.035  -3.383   2.813  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.687  -2.517   5.581  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.435  -2.200   6.394  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.325  -2.910   5.621  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.325  -1.668   3.636  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.124  -3.443   5.902  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.439  -1.733   5.682  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.516  -2.586   7.392  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.256  -1.124   6.386  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.214  -3.919   5.968  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.379  -2.387   5.767  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.507  -4.946   3.334  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.187  -6.064   2.673  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.029  -6.063   1.139  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.451  -7.024   0.494  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.706  -7.387   3.280  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.516  -8.439   2.801  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.587  -5.127   3.723  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.254  -5.982   2.881  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.777  -7.338   4.350  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.667  -7.570   3.006  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.599  -8.303   1.840  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.431  -5.007   0.568  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.122  -4.843  -0.863  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.243  -4.167  -1.670  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.126  -4.014  -2.885  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.869  -3.968  -1.035  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.852  -4.282  -0.111  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.092  -4.293   1.198  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.916  -5.820  -1.304  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.148  -2.940  -0.902  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.489  -4.086  -2.049  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.047  -3.794   0.729  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.295  -3.658  -1.015  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.401  -2.924  -1.649  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.095  -1.469  -2.050  1.00  0.00           C  
+ATOM    223  O   GLY A  15      10.027  -0.688  -2.223  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.323  -3.798  -0.013  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.254  -2.914  -0.971  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.705  -3.456  -2.552  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.815  -1.082  -2.167  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.364   0.285  -2.472  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.898   1.010  -1.194  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.164   0.402  -0.414  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.227   0.209  -3.508  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.864   1.592  -4.069  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.667   1.536  -5.024  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.606   2.733  -5.883  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.305   3.981  -5.540  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.982   4.326  -4.313  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.338   4.924  -6.455  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.121  -1.806  -2.050  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.203   0.825  -2.912  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.538  -0.422  -4.318  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.345  -0.244  -3.049  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.623   2.244  -3.251  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.729   1.984  -4.604  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.756   0.665  -5.645  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.744   1.430  -4.452  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.837   2.583  -6.851  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.989   3.631  -3.582  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       3.762   5.278  -4.085  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.596   4.707  -7.402  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       4.116   5.872  -6.209  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.232   2.303  -0.989  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.749   3.076   0.161  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.224   3.306   0.130  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.612   3.230  -0.945  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.515   4.405   0.107  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.835   4.571  -1.375  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.095   3.134  -1.819  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.009   2.547   1.078  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.905   5.214   0.461  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.445   4.313   0.672  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.005   4.997  -1.906  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.703   5.210  -1.537  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.847   3.012  -2.856  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.137   2.873  -1.630  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.607   3.621   1.290  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.173   3.861   1.391  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.768   5.155   0.668  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.536   6.122   0.654  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.862   3.940   2.889  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.175   4.424   3.496  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.230   3.775   2.601  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.647   3.013   0.960  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.070   4.638   3.081  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.631   2.946   3.269  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.245   5.494   3.460  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.280   4.116   4.536  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.097   4.404   2.530  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.490   2.793   2.996  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.558   5.206   0.088  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.036   6.414  -0.536  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.580   7.431   0.525  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.139   7.063   1.615  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.114   5.918  -1.419  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.641   4.693  -0.668  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.599   4.117   0.004  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.800   6.874  -1.164  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.876   6.667  -1.512  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.288   5.602  -2.384  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.374   4.978   0.062  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.084   3.963  -1.347  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.357   3.758   0.986  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.015   3.321  -0.613  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.671   8.718   0.173  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.166   9.881   0.915  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.789  10.667   0.023  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.886  10.995   0.519  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.319  10.782   1.355  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.016  10.129   2.391  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -0.396  10.900  -1.142  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.997   8.943  -0.756  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.403   9.569   1.792  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.979  10.958   0.527  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.933  11.738   1.713  1.00  0.00           H  
+ATOM    304  HG  SER A  20       1.901   9.185   2.245  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       30                                                                  
+ATOM      1  N   ASN A   1      -6.460   7.364   0.613  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.483   6.556  -0.103  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.889   5.287  -0.732  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.475   4.227  -0.571  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.236   7.406  -1.144  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.303   7.780  -2.289  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -6.233   8.314  -2.043  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -7.597   7.393  -3.514  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.878   6.774   1.192  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.887   7.854  -0.067  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.912   8.053   1.197  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.216   6.208   0.628  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.064   6.843  -1.530  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.607   8.320  -0.677  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -8.429   6.875  -3.745  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -6.919   7.643  -4.219  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.741   5.358  -1.420  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.100   4.220  -2.108  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.341   3.246  -1.180  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.776   2.254  -1.644  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.211   4.795  -3.233  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -5.026   4.979  -4.531  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.502   6.140  -5.376  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.004   3.695  -5.367  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.329   6.267  -1.601  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.882   3.615  -2.569  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.822   5.746  -2.923  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.367   4.131  -3.434  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -6.062   5.205  -4.277  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.492   7.057  -4.785  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.492   5.927  -5.725  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -5.154   6.287  -6.238  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.983   3.466  -5.675  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.397   2.860  -4.791  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.619   3.822  -6.259  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.369   3.488   0.136  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.657   2.701   1.145  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.098   1.228   1.178  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.268   0.347   1.389  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.837   3.357   2.523  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.642   3.161   3.434  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.458   1.945   4.120  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.695   4.196   3.573  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.331   1.761   4.945  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.570   4.016   4.396  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.383   2.798   5.082  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.699   2.647   5.890  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.905   4.281   0.443  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.597   2.723   0.895  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.991   4.410   2.383  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.732   2.959   3.008  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.179   1.149   4.003  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.824   5.137   3.055  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.180   0.826   5.463  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.151   4.808   4.521  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.441   2.460   6.795  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.388   0.955   0.919  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.920  -0.410   0.824  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.170  -1.190  -0.266  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.654  -2.276  -0.009  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.449  -0.413   0.570  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.252   0.393   1.623  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.973  -1.860   0.555  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.642   1.792   1.136  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -6.009   1.734   0.758  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.730  -0.915   1.773  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.642   0.008  -0.418  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.148  -0.149   1.858  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.684   0.477   2.549  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.552  -2.404  -0.285  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.704  -2.366   1.485  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.059  -1.868   0.448  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.779   2.452   1.188  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.018   1.751   0.113  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.431   2.192   1.775  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.097  -0.628  -1.481  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.416  -1.240  -2.624  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.926  -1.482  -2.349  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.406  -2.535  -2.707  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.601  -0.369  -3.878  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.909  -1.238  -5.106  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.680  -0.468  -6.398  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.535   0.265  -6.866  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -3.518  -0.604  -7.008  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.464   0.307  -1.591  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.871  -2.214  -2.798  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.414   0.312  -3.716  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.691   0.207  -4.059  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.269  -2.099  -5.094  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.953  -1.554  -5.065  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -2.791  -1.203  -6.654  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.429  -0.080  -7.861  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.259  -0.532  -1.681  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.876  -0.690  -1.231  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.716  -1.832  -0.211  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.176  -2.668  -0.361  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.374   0.647  -0.679  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.038   0.612  -0.187  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.141   0.697  -0.963  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.520   0.464   1.184  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.265   0.595  -0.168  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.944   0.448   1.159  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.902   0.355   2.448  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.724   0.344   2.317  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.675   0.244   3.623  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.080   0.249   3.561  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.752   0.326  -1.458  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.260  -0.952  -2.093  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.441   1.380  -1.459  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -1.015   0.962   0.144  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.138   0.826  -2.038  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.223   0.685  -0.491  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.175   0.378   2.506  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.802   0.341   2.239  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.187   0.174   4.582  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.663   0.185   4.467  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.599  -1.914   0.796  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.593  -3.012   1.768  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.846  -4.384   1.129  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.193  -5.345   1.538  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.602  -2.751   2.902  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.105  -1.780   3.989  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.232  -1.537   4.996  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.894  -2.319   4.764  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.301  -1.181   0.888  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.591  -3.074   2.189  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.494  -2.341   2.469  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.838  -3.699   3.387  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.835  -0.833   3.527  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.108  -1.139   4.483  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.500  -2.472   5.489  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.913  -0.822   5.752  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.122  -3.301   5.179  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.027  -2.398   4.112  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.639  -1.639   5.576  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.722  -4.491   0.113  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.959  -5.749  -0.626  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.683  -6.372  -1.201  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.595  -7.593  -1.269  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.007  -5.555  -1.743  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.443  -5.846  -1.265  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.440  -4.718  -1.552  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.997  -4.739  -2.978  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.865  -3.560  -3.222  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.252  -3.655  -0.124  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.328  -6.495   0.081  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.958  -4.540  -2.087  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.787  -6.243  -2.562  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.788  -6.734  -1.758  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.439  -6.011  -0.187  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -7.260  -4.808  -0.866  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.951  -3.767  -1.378  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -6.181  -4.725  -3.675  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.572  -5.660  -3.111  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -8.644  -3.562  -2.574  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.341  -2.706  -3.093  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.232  -3.580  -4.164  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.696  -5.556  -1.580  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.598  -6.026  -2.075  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.519  -6.577  -0.966  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.545  -7.185  -1.279  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.286  -4.862  -2.807  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.136  -5.346  -3.982  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.579  -5.513  -5.084  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.373  -5.444  -3.814  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.850  -4.558  -1.514  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.421  -6.829  -2.794  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.534  -4.192  -3.177  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.907  -4.305  -2.103  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.200  -6.338   0.319  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.994  -6.734   1.492  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.551  -5.569   2.334  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.261  -5.808   3.315  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.312  -5.879   0.502  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.360  -7.337   2.142  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.835  -7.356   1.186  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.238  -4.314   1.983  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.630  -3.135   2.756  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.156  -2.921   2.790  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.786  -2.907   1.729  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.725  -4.177   1.122  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.172  -2.252   2.310  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.237  -3.250   3.763  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.785  -2.743   3.974  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.237  -2.551   4.077  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.066  -3.702   3.485  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.207  -3.486   3.077  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.543  -2.392   5.572  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.203  -2.021   6.203  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.182  -2.709   5.300  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.501  -1.628   3.560  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.913  -3.312   5.983  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.291  -1.616   5.745  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.137  -2.391   7.208  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.065  -0.941   6.157  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.987  -3.705   5.648  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.247  -2.149   5.311  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.502  -4.917   3.405  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.196  -6.128   2.940  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.128  -6.326   1.416  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.334  -7.437   0.931  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.674  -7.367   3.682  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.833  -7.217   5.081  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.524  -4.999   3.654  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.254  -6.034   3.186  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.633  -7.499   3.458  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.251  -8.238   3.368  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.115  -6.675   5.416  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.854  -5.257   0.662  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.584  -5.293  -0.785  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.566  -4.459  -1.616  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.367  -4.289  -2.817  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.146  -4.838  -1.031  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.277  -5.620  -0.252  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.601  -4.410   1.157  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.658  -6.321  -1.144  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.044  -3.806  -0.757  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.908  -4.937  -2.086  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.762  -6.253  -0.814  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.616  -3.911  -0.986  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.650  -3.115  -1.655  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.148  -1.778  -2.215  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.705  -1.282  -3.192  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.720  -4.130  -0.003  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.451  -2.904  -0.947  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.069  -3.693  -2.479  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.090  -1.203  -1.622  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.417   0.014  -2.096  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.924   0.888  -0.926  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.280   0.358  -0.018  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.269  -0.371  -3.052  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.250  -1.359  -2.458  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.104  -1.695  -3.419  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.341  -2.957  -4.134  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.904  -3.201  -5.305  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       5.427  -2.257  -6.053  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.910  -4.436  -5.734  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.706  -1.667  -0.809  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.145   0.582  -2.674  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.747   0.525  -3.327  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.708  -0.821  -3.943  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.762  -2.268  -2.207  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.813  -0.934  -1.563  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.194  -1.780  -2.857  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.933  -0.873  -4.115  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.985  -3.821  -3.714  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.402  -1.317  -5.706  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       5.836  -2.486  -6.938  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.381  -5.092  -5.130  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       5.299  -4.728  -6.606  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.173   2.212  -0.928  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.709   3.107   0.135  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.179   3.304   0.093  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.572   3.105  -0.963  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.453   4.424  -0.105  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.690   4.435  -1.615  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.884   2.960  -1.955  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.996   2.696   1.103  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.854   5.262   0.195  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.414   4.395   0.413  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.842   4.840  -2.134  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.568   5.026  -1.881  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.475   2.744  -2.923  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.945   2.707  -1.917  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.547   3.703   1.215  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.107   3.958   1.273  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.718   5.246   0.522  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.537   6.161   0.405  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.775   4.060   2.766  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.078   4.556   3.393  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.157   3.921   2.519  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.574   3.114   0.842  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.979   4.759   2.934  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.537   3.072   3.156  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.137   5.627   3.359  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.168   4.245   4.434  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.999   4.580   2.430  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.454   2.961   2.942  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.462   5.356   0.042  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.965   6.565  -0.607  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.679   7.670   0.424  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.133   7.394   1.493  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.307   6.120  -1.337  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.842   4.980  -0.470  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.425   4.333   0.092  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.694   6.927  -1.334  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.016   6.923  -1.394  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.038   5.730  -2.321  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.462   5.358   0.320  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.427   4.271  -1.057  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.263   4.017   1.104  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.718   3.493  -0.537  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.033   8.915   0.077  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.705  10.139   0.828  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.786  10.478   0.742  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.375  10.693   1.822  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.520  11.322   0.296  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.902  11.054   0.415  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.297  10.548  -0.398  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.493   9.051  -0.810  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.929   9.985   1.882  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.278  11.484  -0.737  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.270  12.218   0.868  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.079  10.774   1.317  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       31                                                                  
+ATOM      1  N   ASN A   1      -5.909   7.522   0.267  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.878   6.859  -0.640  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.387   5.474  -1.074  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.073   4.506  -0.795  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.238   7.752  -1.848  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -6.030   7.972  -2.754  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -4.939   8.212  -2.259  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -6.143   7.768  -4.052  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.599   6.883   0.986  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.112   7.842  -0.277  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.337   8.328   0.703  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.798   6.680  -0.079  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.017   7.278  -2.413  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.592   8.722  -1.493  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -7.007   7.508  -4.498  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -5.297   7.914  -4.581  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.214   5.357  -1.714  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.723   4.133  -2.374  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.072   3.112  -1.410  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.514   2.099  -1.824  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.784   4.570  -3.527  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.051   3.825  -4.857  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.094   4.806  -6.033  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.990   2.766  -5.156  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.694   6.204  -1.928  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.592   3.628  -2.801  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.918   5.621  -3.694  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.742   4.452  -3.229  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.023   3.338  -4.815  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.920   5.505  -5.900  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.158   5.361  -6.096  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.250   4.259  -6.963  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -2.068   3.238  -5.500  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -2.771   2.189  -4.262  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -3.360   2.093  -5.930  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.158   3.379  -0.100  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.550   2.591   0.970  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.064   1.142   1.019  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.312   0.246   1.398  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.780   3.308   2.312  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.551   3.326   3.197  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.261   2.225   4.024  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.687   4.439   3.181  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.106   2.230   4.829  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.529   4.448   3.976  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.232   3.340   4.800  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.880   3.349   5.583  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.674   4.203   0.150  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.477   2.550   0.784  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.071   4.321   2.112  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.604   2.835   2.848  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -2.925   1.374   4.033  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.899   5.294   2.555  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -0.876   1.391   5.467  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.134   5.301   3.953  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.691   3.713   6.450  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.318   0.899   0.604  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.916  -0.442   0.543  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.144  -1.321  -0.447  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.704  -2.405  -0.072  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.426  -0.393   0.201  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.210   0.560   1.137  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.041  -1.802   0.286  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.670   1.817   0.395  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.870   1.690   0.302  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.811  -0.900   1.529  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.537  -0.053  -0.832  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.071   0.045   1.518  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.591   0.854   1.986  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.564  -2.474  -0.427  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.920  -2.203   1.294  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.103  -1.755   0.046  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.834   2.238  -0.159  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.467   1.560  -0.304  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.041   2.553   1.108  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.941  -0.843  -1.684  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.117  -1.514  -2.693  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.686  -1.746  -2.187  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.209  -2.879  -2.229  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.134  -0.708  -4.002  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.442  -0.901  -4.795  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.166   0.412  -5.082  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.464   1.188  -4.184  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.497   0.688  -6.330  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.307   0.072  -1.913  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.539  -2.498  -2.896  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.024   0.333  -3.767  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.302  -1.031  -4.631  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.209  -1.374  -5.729  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.129  -1.543  -4.244  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.283   0.067  -7.093  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.002   1.548  -6.458  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.034  -0.709  -1.645  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.678  -0.829  -1.093  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.567  -1.888   0.023  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.376  -2.684   0.030  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.200   0.546  -0.612  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.200   0.544  -0.082  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.322   0.559  -0.836  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.651   0.467   1.306  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.427   0.481  -0.014  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.075   0.428   1.313  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.006   0.418   2.560  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.828   0.362   2.492  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.749   0.341   3.754  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.155   0.321   3.723  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.492   0.198  -1.645  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.016  -1.157  -1.898  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.249   1.230  -1.438  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.866   0.904   0.171  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.344   0.600  -1.918  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.399   0.465  -0.330  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.073   0.449   2.593  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.906   0.339   2.439  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.239   0.310   4.706  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.716   0.279   4.647  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.531  -1.946   0.950  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.587  -3.012   1.954  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.883  -4.387   1.338  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.259  -5.363   1.752  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.605  -2.670   3.056  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.118  -1.596   4.051  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.255  -1.244   5.014  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.920  -2.061   4.892  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.264  -1.238   0.941  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.599  -3.102   2.404  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.502  -2.314   2.587  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.828  -3.576   3.621  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.835  -0.698   3.507  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.107  -0.863   4.451  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.559  -2.129   5.572  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.924  -0.478   5.716  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.159  -2.994   5.401  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.046  -2.207   4.261  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.673  -1.303   5.635  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.772  -4.477   0.334  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.105  -5.716  -0.398  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.879  -6.425  -0.982  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.855  -7.653  -0.986  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.125  -5.413  -1.517  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.509  -6.032  -1.296  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.571  -7.539  -1.610  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.790  -7.876  -2.484  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.467  -7.814  -3.931  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.262  -3.623   0.071  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.545  -6.418   0.311  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.241  -4.349  -1.587  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.737  -5.743  -2.483  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.784  -5.888  -0.269  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.212  -5.498  -1.938  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -4.677  -7.825  -2.131  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.653  -8.084  -0.669  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.125  -8.867  -2.245  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.598  -7.177  -2.246  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -6.123  -6.897  -4.179  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -5.753  -8.496  -4.155  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.289  -8.017  -4.487  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.876  -5.673  -1.449  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.398  -6.223  -1.930  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.311  -6.762  -0.805  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.203  -7.564  -1.082  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.147  -5.144  -2.731  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.467  -4.801  -4.061  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.157  -5.754  -4.813  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.290  -3.591  -4.324  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.030  -4.670  -1.499  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.195  -7.060  -2.600  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.201  -4.253  -2.136  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.152  -5.505  -2.957  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.096  -6.352   0.456  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.939  -6.705   1.606  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.565  -5.512   2.347  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.435  -5.730   3.206  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.261  -5.800   0.631  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.326  -7.256   2.320  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.746  -7.365   1.289  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.176  -4.272   2.029  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.626  -3.057   2.710  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.158  -2.915   2.747  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.789  -2.963   1.691  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.547  -4.148   1.241  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.223  -2.195   2.180  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.209  -3.058   3.715  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.800  -2.763   3.930  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.259  -2.630   4.030  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.037  -3.777   3.366  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.146  -3.571   2.879  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.578  -2.563   5.529  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.267  -2.123   6.174  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.203  -2.726   5.258  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.554  -1.691   3.560  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.879  -3.525   5.897  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.381  -1.855   5.734  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.180  -2.511   7.171  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.195  -1.035   6.150  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.949  -3.717   5.582  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.303  -2.112   5.287  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.444  -4.979   3.307  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.043  -6.156   2.670  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.983  -6.137   1.130  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.548  -7.021   0.494  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.428  -7.435   3.253  1.00  0.00           C  
+ATOM    203  OG  SER A  13       5.089  -7.644   2.842  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.500  -5.052   3.666  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.101  -6.173   2.933  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       7.018  -8.273   2.935  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.467  -7.386   4.343  1.00  0.00           H  
+ATOM    208  HG  SER A  13       4.507  -6.893   3.104  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.343  -5.125   0.518  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.214  -4.963  -0.941  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.325  -4.127  -1.595  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.306  -3.936  -2.809  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.882  -4.280  -1.265  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.823  -4.982  -0.663  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.902  -4.413   1.097  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.217  -5.946  -1.415  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.899  -3.274  -0.893  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.731  -4.256  -2.345  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.199  -5.674  -0.113  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.258  -3.554  -0.822  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.356  -2.717  -1.330  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.956  -1.287  -1.733  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.753  -0.366  -1.564  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.204  -3.723   0.175  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.135  -2.654  -0.570  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.789  -3.199  -2.207  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.740  -1.078  -2.255  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.196   0.244  -2.606  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.800   1.026  -1.334  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.153   0.438  -0.465  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.004   0.043  -3.562  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.598   1.337  -4.286  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.649   1.070  -5.464  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.376   0.549  -6.647  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.988   1.239  -7.584  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.011   2.568  -7.581  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       6.613   0.642  -8.574  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.177  -1.909  -2.406  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       7.984   0.785  -3.128  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.273  -0.691  -4.297  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.146  -0.347  -3.007  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.106   1.985  -3.586  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.488   1.833  -4.670  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.914   0.349  -5.162  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.142   2.000  -5.728  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.404  -0.458  -6.736  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.535   3.037  -6.833  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       6.471   3.081  -8.301  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       6.628  -0.366  -8.623  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       7.076   1.176  -9.280  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.126   2.330  -1.200  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.809   3.113   0.002  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.294   3.369   0.169  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.551   3.273  -0.812  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.588   4.425  -0.160  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.688   4.594  -1.672  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.850   3.156  -2.157  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.177   2.582   0.880  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.056   5.245   0.283  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.589   4.309   0.258  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.798   5.040  -2.072  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.535   5.216  -1.960  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.432   3.044  -3.139  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.905   2.879  -2.151  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.828   3.720   1.386  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.415   3.979   1.661  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.921   5.257   0.956  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.633   6.262   0.960  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.307   4.111   3.185  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.701   4.568   3.609  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.614   3.867   2.605  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.830   3.121   1.340  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.567   4.840   3.454  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       3.099   3.135   3.621  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.796   5.634   3.537  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.929   4.279   4.636  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.488   4.461   2.417  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.884   2.880   2.982  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.704   5.254   0.376  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.131   6.433  -0.268  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.578   7.422   0.772  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.096   7.022   1.725  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.032   5.878  -1.180  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.464   4.639  -0.433  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.792   4.121   0.270  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.886   6.934  -0.875  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.759   6.592  -1.305  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.474   5.572  -2.129  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.223   4.899   0.279  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.879   3.897  -1.115  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.545   3.752   1.247  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.257   3.344  -0.337  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.825   8.716   0.549  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.360   9.847   1.362  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.255  10.948   0.496  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.173  11.092  -0.672  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.496  10.383   2.241  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.667  10.641   1.485  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.188  11.592   1.023  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.372   9.005  -0.251  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.439   9.514   2.020  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.175  11.295   2.707  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       1.726   9.639   3.008  1.00  0.00           H  
+ATOM    304  HG  SER A  20       3.313  11.084   2.036  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       32                                                                  
+ATOM      1  N   ASN A   1      -6.852   6.802   0.784  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.569   5.905  -0.155  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.675   4.784  -0.685  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.907   3.637  -0.312  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.306   6.688  -1.259  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.658   7.144  -0.720  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.402   6.342  -0.185  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -9.997   8.418  -0.771  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.406   6.262   1.512  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -6.150   7.342   0.294  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -7.507   7.441   1.214  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.341   5.383   0.416  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.724   7.543  -1.544  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.496   6.032  -2.110  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.452   9.144  -1.207  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -10.916   8.601  -0.396  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.641   5.081  -1.489  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.771   4.070  -2.118  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.066   3.118  -1.122  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.610   2.044  -1.507  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.736   4.788  -3.009  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.207   3.896  -4.155  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.121   3.970  -5.385  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -1.783   4.286  -4.551  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.488   6.032  -1.793  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.401   3.449  -2.761  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.197   5.657  -3.437  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.911   5.107  -2.379  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.172   2.861  -3.826  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -5.104   4.362  -5.124  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.683   4.602  -6.157  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.253   2.966  -5.790  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.718   5.358  -4.736  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.099   4.008  -3.752  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -1.488   3.743  -5.449  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.017   3.470   0.169  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.452   2.660   1.248  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.002   1.221   1.271  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.253   0.284   1.527  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.690   3.373   2.590  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.578   3.161   3.597  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.514   1.966   4.339  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.601   4.161   3.787  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.479   1.768   5.270  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.567   3.969   4.722  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.503   2.769   5.464  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.485   2.574   6.378  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.399   4.368   0.410  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.376   2.600   1.088  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.782   4.426   2.403  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.635   3.037   3.021  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.259   1.196   4.191  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.635   5.081   3.217  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.416   0.856   5.843  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.180   4.734   4.872  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.286   3.012   7.208  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.291   1.031   0.946  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.931  -0.293   0.853  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.280  -1.132  -0.262  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.975  -2.308  -0.057  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.452  -0.139   0.612  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.150   0.694   1.716  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.133  -1.519   0.519  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.405   1.406   1.195  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.843   1.851   0.722  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.780  -0.822   1.794  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.585   0.372  -0.343  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.432   0.039   2.518  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.485   1.468   2.099  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.763  -2.077  -0.343  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.934  -2.097   1.423  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.211  -1.406   0.405  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.143   2.050   0.354  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.152   0.681   0.875  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.826   2.022   1.989  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.043  -0.527  -1.433  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.319  -1.165  -2.532  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.856  -1.426  -2.147  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.382  -2.537  -2.342  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.432  -0.330  -3.822  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.812  -0.453  -4.498  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.574   0.869  -4.544  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.511   1.619  -5.500  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.337   1.205  -3.520  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.183   0.474  -1.483  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.763  -2.143  -2.723  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.261   0.701  -3.579  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.682  -0.687  -4.528  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.671  -0.801  -5.503  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.424  -1.202  -3.994  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.488   0.604  -2.731  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.851   2.055  -3.678  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.161  -0.464  -1.529  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.783  -0.667  -1.057  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.645  -1.797  -0.021  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.314  -2.570  -0.062  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.249   0.652  -0.495  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.135   0.570   0.072  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.275   0.562  -0.652  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.545   0.458   1.469  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.360   0.439   0.197  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.968   0.390   1.513  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.867   0.423   2.708  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.691   0.320   2.711  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.580   0.342   3.919  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.987   0.304   3.924  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.607   0.442  -1.410  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.164  -0.953  -1.911  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.245   1.376  -1.287  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.917   0.998   0.291  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.321   0.634  -1.731  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.338   0.431  -0.094  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.213   0.476   2.719  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.771   0.289   2.684  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.047   0.329   4.859  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.522   0.272   4.860  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.613  -1.946   0.894  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.654  -3.093   1.806  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.835  -4.426   1.058  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.246  -5.420   1.478  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.752  -2.898   2.866  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.416  -1.848   3.943  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.648  -1.629   4.827  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.246  -2.272   4.838  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.340  -1.237   0.952  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.691  -3.164   2.309  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.651  -2.591   2.366  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.928  -3.852   3.365  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.156  -0.903   3.474  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.482  -1.286   4.215  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.923  -2.562   5.321  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.435  -0.875   5.585  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.429  -3.262   5.255  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.321  -2.286   4.263  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.123  -1.560   5.652  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.573  -4.450  -0.065  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.753  -5.637  -0.920  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.423  -6.194  -1.444  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.285  -7.410  -1.532  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.680  -5.295  -2.099  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.298  -6.504  -2.814  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.536  -7.065  -2.098  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.303  -8.006  -3.036  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -7.007  -7.254  -4.106  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -2.995  -3.577  -0.362  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.211  -6.421  -0.316  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.480  -4.685  -1.727  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.094  -4.770  -2.849  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.583  -6.205  -3.804  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -3.557  -7.296  -2.934  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.227  -7.608  -1.225  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.190  -6.253  -1.779  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.610  -8.689  -3.488  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.027  -8.580  -2.453  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.790  -6.744  -3.720  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.372  -6.589  -4.533  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -7.345  -7.883  -4.822  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.447  -5.329  -1.753  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.910  -5.749  -2.133  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.670  -6.459  -0.990  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.622  -7.186  -1.270  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.736  -4.535  -2.594  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.220  -3.854  -3.861  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.591  -4.337  -4.953  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       0.541  -2.814  -3.721  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.655  -4.337  -1.719  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.844  -6.450  -2.966  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.736  -3.811  -1.802  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.749  -4.874  -2.808  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.257  -6.258   0.274  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.961  -6.712   1.480  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.411  -5.586   2.425  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.160  -5.849   3.367  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.383  -5.760   0.408  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.304  -7.377   2.037  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.850  -7.277   1.196  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.008  -4.326   2.183  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.450  -3.174   2.973  1.00  0.00           C  
+ATOM    179  C   GLY A  11       3.980  -2.984   2.932  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.559  -3.040   1.839  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.456  -4.151   1.354  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.984  -2.274   2.571  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.101  -3.314   3.994  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.665  -2.766   4.078  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.116  -2.537   4.125  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.959  -3.639   3.466  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.019  -3.357   2.912  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.477  -2.417   5.612  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.164  -2.042   6.293  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.110  -2.726   5.425  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.331  -1.590   3.630  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.847  -3.351   5.989  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.243  -1.658   5.777  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.133  -2.413   7.299  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.028  -0.961   6.254  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.922  -3.721   5.781  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.178  -2.162   5.468  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.486  -4.890   3.490  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.202  -6.073   2.992  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.143  -6.241   1.464  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.476  -7.309   0.957  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.669  -7.320   3.710  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.903  -7.208   5.102  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.586  -5.054   3.924  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.256  -5.969   3.247  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.615  -7.410   3.532  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.175  -8.210   3.337  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.852  -7.195   5.257  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.739  -5.198   0.725  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.405  -5.266  -0.708  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.371  -4.503  -1.623  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.116  -4.406  -2.826  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.983  -4.759  -0.973  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.134  -4.862   0.138  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.478  -4.368   1.241  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.427  -6.311  -1.020  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.039  -3.727  -1.263  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.571  -5.340  -1.796  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.313  -4.115   0.764  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.442  -3.922  -1.059  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.474  -3.182  -1.792  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.029  -1.817  -2.334  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.636  -1.322  -3.282  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.567  -4.078  -0.067  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.326  -3.018  -1.132  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.816  -3.786  -2.634  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.971  -1.217  -1.769  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.354   0.032  -2.244  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.844   0.894  -1.071  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.204   0.347  -0.168  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.234  -0.313  -3.248  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.064  -1.085  -2.611  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.139  -1.794  -3.605  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.801  -2.956  -4.225  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.278  -3.071  -5.455  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       5.210  -2.093  -6.329  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.864  -4.186  -5.822  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.549  -1.675  -0.973  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.120   0.589  -2.783  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.854   0.601  -3.662  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.672  -0.909  -4.049  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.474  -1.825  -1.951  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.465  -0.382  -2.044  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.261  -2.128  -3.087  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.785  -1.084  -4.353  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       4.929  -3.770  -3.646  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.742  -1.252  -6.044  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       5.588  -2.189  -7.251  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.998  -4.910  -5.134  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.200  -4.304  -6.756  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.087   2.220  -1.065  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.655   3.106   0.019  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.123   3.267   0.052  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.470   3.043  -0.971  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.355   4.442  -0.256  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.509   4.455  -1.776  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.758   2.986  -2.109  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.997   2.705   0.974  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.753   5.266   0.076  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.342   4.438   0.209  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.616   4.812  -2.251  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.338   5.087  -2.096  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.347   2.746  -3.071  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.828   2.777  -2.079  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.537   3.673   1.196  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.102   3.903   1.304  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.667   5.149   0.509  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.454   6.085   0.353  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.819   4.069   2.799  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.134   4.621   3.345  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.189   3.944   2.471  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.575   3.028   0.934  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.014   4.759   2.964  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.618   3.095   3.244  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.176   5.688   3.241  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.266   4.380   4.399  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.030   4.595   2.329  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.495   3.002   2.927  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.416   5.184   0.020  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.856   6.338  -0.670  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.274   7.370   0.308  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.285   7.006   1.346  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.241   5.744  -1.552  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.772   4.583  -0.706  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.476   4.073   0.003  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.613   6.813  -1.296  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.012   6.464  -1.746  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.214   5.358  -2.465  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.504   4.924   0.000  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.221   3.803  -1.320  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.238   3.772   1.005  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.911   3.257  -0.574  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.317   8.642  -0.115  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.113   9.835   0.640  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.639  10.031   1.968  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.066  10.720   2.840  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.636   9.826   0.849  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.305   9.711  -0.395  1.00  0.00           O  
+ATOM    299  OXT SER A  20       1.796   9.565   2.056  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.838   8.806  -0.960  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.140  10.716   0.055  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -1.902   8.994   1.472  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.934  10.755   1.339  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.851  10.287  -1.014  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       33                                                                  
+ATOM      1  N   ASN A   1      -9.696   2.810  -1.214  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.702   3.862  -0.904  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.320   3.416  -1.392  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.058   2.216  -1.401  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -8.682   4.180   0.603  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.901   5.460   0.875  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -6.683   5.431   0.961  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.563   6.601   0.949  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -9.798   2.712  -2.215  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -9.371   1.928  -0.840  1.00  0.00           H  
+ATOM     11  H3  ASN A   1     -10.593   3.041  -0.806  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.978   4.770  -1.442  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -9.690   4.302   0.950  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.208   3.365   1.150  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.568   6.669   0.919  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -7.997   7.418   1.129  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.450   4.362  -1.773  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -5.070   4.110  -2.206  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.261   3.274  -1.198  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.535   2.363  -1.600  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -4.351   5.440  -2.547  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.514   6.597  -1.528  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.229   7.411  -1.372  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.623   7.572  -1.951  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.706   5.331  -1.654  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.109   3.519  -3.122  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.303   5.230  -2.636  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -4.699   5.782  -3.523  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.759   6.191  -0.552  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.500   6.830  -0.816  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.824   7.681  -2.347  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.422   8.320  -0.800  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -5.295   8.148  -2.819  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -6.539   7.048  -2.209  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.828   8.260  -1.132  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.415   3.532   0.107  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.672   2.802   1.139  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.041   1.307   1.188  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.171   0.461   1.386  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.879   3.480   2.497  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.767   3.185   3.485  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.814   2.034   4.294  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.673   4.066   3.584  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.769   1.770   5.202  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.633   3.814   4.497  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.678   2.659   5.305  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.328   2.397   6.181  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -5.030   4.292   0.388  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.611   2.866   0.893  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.928   4.541   2.345  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.839   3.176   2.920  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.646   1.348   4.217  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.623   4.947   2.966  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.786   0.898   5.835  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.183   4.517   4.582  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.000   3.080   6.149  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.317   0.964   0.945  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.797  -0.427   0.890  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.106  -1.182  -0.260  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.649  -2.312  -0.079  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.343  -0.481   0.776  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.026   0.176   2.003  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.809  -1.944   0.634  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.518   0.486   1.806  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.958   1.710   0.720  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.510  -0.925   1.817  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.647   0.059  -0.122  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.929  -0.490   2.838  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.538   1.122   2.236  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.478  -2.358  -0.319  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.398  -2.547   1.445  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.894  -2.016   0.659  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -9.642   1.219   1.013  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4     -10.080  -0.412   1.556  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.924   0.899   2.728  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.987  -0.542  -1.429  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.265  -1.071  -2.589  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.780  -1.329  -2.278  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.258  -2.372  -2.663  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.444  -0.110  -3.783  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.274  -0.705  -4.937  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -4.406  -1.168  -6.106  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -3.743  -0.382  -6.761  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -4.396  -2.444  -6.437  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.362   0.397  -1.487  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.696  -2.043  -2.836  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.937   0.777  -3.433  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.468   0.199  -4.159  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.827  -1.546  -4.565  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.939   0.070  -5.317  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.933  -3.137  -5.951  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -3.802  -2.637  -7.226  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.110  -0.425  -1.550  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.735  -0.642  -1.083  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.618  -1.798  -0.074  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.284  -2.632  -0.196  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.178   0.660  -0.502  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.220   0.560   0.030  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.344   0.499  -0.720  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.660   0.470   1.420  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.446   0.394   0.108  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.084   0.389   1.433  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.008   0.446   2.674  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.829   0.330   2.618  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.746   0.354   3.871  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.152   0.312   3.847  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.590   0.437  -1.304  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.120  -0.916  -1.942  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.189   1.403  -1.276  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.826   1.000   0.307  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.370   0.522  -1.801  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.422   0.342  -0.195  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.071   0.498   2.709  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.908   0.276   2.569  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.228   0.327   4.819  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.709   0.259   4.771  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.541  -1.889   0.896  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.582  -3.011   1.838  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.783  -4.360   1.136  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.117  -5.321   1.517  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.666  -2.803   2.908  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.354  -1.713   3.950  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.542  -1.608   4.912  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.090  -2.018   4.764  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.233  -1.146   0.975  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.612  -3.079   2.329  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.578  -2.536   2.410  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.803  -3.746   3.442  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.222  -0.755   3.451  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.453  -1.399   4.353  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.663  -2.544   5.458  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.376  -0.804   5.626  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.148  -3.021   5.187  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.210  -1.944   4.128  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.982  -1.297   5.571  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.633  -4.432   0.094  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -2.884  -5.655  -0.692  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.596  -6.330  -1.179  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.525  -7.556  -1.201  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.808  -5.329  -1.882  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.241  -6.587  -2.655  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.060  -6.237  -3.903  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.306  -7.504  -4.738  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -4.559  -7.485  -6.019  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.173  -3.595  -0.117  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.386  -6.377  -0.047  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.685  -4.834  -1.511  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.277  -4.670  -2.567  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -3.365  -7.128  -2.956  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -4.835  -7.226  -2.000  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.002  -5.819  -3.605  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -4.524  -5.490  -4.491  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -4.994  -8.359  -4.169  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.379  -7.594  -4.932  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -4.868  -6.712  -6.594  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -3.566  -7.387  -5.848  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -4.715  -8.344  -6.529  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.590  -5.540  -1.563  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.696  -6.034  -2.059  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.604  -6.602  -0.943  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.534  -7.350  -1.236  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.377  -4.885  -2.828  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.180  -5.390  -4.029  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.517  -5.724  -5.041  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.423  -5.398  -3.944  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.734  -4.540  -1.523  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.502  -6.844  -2.765  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.622  -4.207  -3.177  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.011  -4.308  -2.158  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.315  -6.291   0.335  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.125  -6.667   1.501  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.634  -5.488   2.350  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.490  -5.686   3.216  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.438  -5.808   0.503  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.519  -7.303   2.147  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.993  -7.245   1.182  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.132  -4.266   2.113  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.535  -3.041   2.809  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.061  -2.833   2.842  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.676  -2.729   1.777  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.459  -4.179   1.364  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.091  -2.192   2.292  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.124  -3.070   3.815  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.716  -2.764   4.022  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.173  -2.628   4.110  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.953  -3.752   3.413  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.085  -3.532   2.985  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.510  -2.614   5.607  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.200  -2.211   6.279  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.136  -2.801   5.356  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.463  -1.674   3.669  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.824  -3.586   5.936  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.309  -1.906   5.829  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.129  -2.629   7.265  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.116  -1.124   6.289  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.912  -3.811   5.640  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.224  -2.208   5.422  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.364  -4.949   3.290  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.032  -6.120   2.719  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.005  -6.154   1.183  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.560  -7.084   0.599  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.426  -7.399   3.310  1.00  0.00           C  
+ATOM    203  OG  SER A  13       7.402  -8.420   3.301  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.392  -5.053   3.575  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.080  -6.085   3.021  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       6.109  -7.214   4.318  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       5.557  -7.710   2.730  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.730  -8.506   2.397  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.381  -5.157   0.538  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.165  -5.055  -0.915  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.342  -4.457  -1.697  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.309  -4.428  -2.924  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.964  -4.138  -1.174  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.864  -4.511  -0.377  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.881  -4.475   1.098  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.937  -6.042  -1.321  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.238  -3.127  -0.943  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.688  -4.185  -2.225  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.188  -3.835  -0.468  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.357  -3.909  -1.017  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.474  -3.213  -1.669  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.156  -1.791  -2.160  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.942  -1.231  -2.920  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.341  -3.994  -0.010  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.311  -3.152  -0.976  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.800  -3.797  -2.532  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.024  -1.197  -1.741  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.568   0.140  -2.156  1.00  0.00           C  
+ATOM    229  C   ARG A  16       7.012   0.930  -0.956  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.231   0.354  -0.196  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.504  -0.029  -3.256  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       6.136   1.305  -3.920  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       5.111   1.119  -5.043  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.902   2.373  -5.790  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.118   3.394  -5.467  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.401   3.409  -4.368  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.046   4.440  -6.259  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.441  -1.716  -1.100  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.423   0.671  -2.576  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.886  -0.694  -4.006  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.608  -0.485  -2.831  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.722   1.960  -3.177  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       7.039   1.747  -4.344  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.466   0.364  -5.719  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.167   0.759  -4.628  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.422   2.462  -6.647  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       3.504   2.647  -3.718  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.814   4.189  -4.136  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.589   4.478  -7.103  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.453   5.213  -6.014  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.341   2.229  -0.790  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.828   3.050   0.313  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.302   3.268   0.240  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.711   3.118  -0.837  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.588   4.382   0.217  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.955   4.479  -1.259  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.236   3.024  -1.624  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.073   2.564   1.257  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.962   5.202   0.511  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.498   4.326   0.815  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.141   4.874  -1.836  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.825   5.116  -1.425  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       8.031   2.852  -2.663  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.270   2.778  -1.381  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.658   3.643   1.366  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.221   3.898   1.414  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.834   5.170   0.637  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.623   6.115   0.574  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.872   4.023   2.901  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.173   4.506   3.536  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.248   3.833   2.686  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.702   3.039   0.999  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.085   4.736   3.051  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.619   3.041   3.300  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.254   5.575   3.483  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.246   4.214   4.585  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.117   4.459   2.619  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.501   2.862   3.113  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.620   5.223   0.057  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.139   6.367  -0.722  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.477   7.473   0.123  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.201   8.545  -0.412  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.125   5.747  -1.684  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.519   4.650  -0.831  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.673   4.117  -0.040  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.956   6.812  -1.290  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.603   6.470  -1.999  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.651   5.295  -2.525  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.270   5.054  -0.179  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.979   3.875  -1.444  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.362   3.806   0.939  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.138   3.304  -0.597  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.213   7.210   1.410  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.379   8.118   2.401  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.477   8.085   3.667  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.871   9.175   4.129  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.821   7.700   2.717  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.657   8.835   2.780  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.731   6.946   4.124  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.539   6.334   1.792  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.376   9.140   2.021  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.175   7.041   1.948  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.844   7.173   3.675  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -3.473   8.604   3.228  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       34                                                                  
+ATOM      1  N   ASN A   1      -5.799   7.830  -0.622  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.880   6.904  -1.045  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.385   5.527  -1.533  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.195   4.623  -1.680  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.825   7.579  -2.066  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -9.296   7.287  -1.763  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -9.622   6.455  -0.932  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -10.226   7.998  -2.373  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.221   7.401   0.088  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.228   8.093  -1.416  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.207   8.670  -0.235  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.484   6.690  -0.160  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.668   8.640  -2.035  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -7.593   7.245  -3.078  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -10.030   8.724  -3.044  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -11.167   7.758  -2.108  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.074   5.320  -1.762  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.517   4.062  -2.295  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.967   3.102  -1.219  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.428   2.045  -1.548  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.448   4.425  -3.346  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.051   4.779  -4.719  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.023   5.544  -5.556  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.473   3.517  -5.479  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.397   6.057  -1.657  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.309   3.505  -2.795  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -2.890   5.269  -2.989  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.757   3.592  -3.484  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.923   5.421  -4.583  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -2.817   6.509  -5.095  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.096   4.973  -5.628  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.417   5.717  -6.558  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.615   2.859  -5.616  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.251   2.986  -4.932  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -4.869   3.792  -6.456  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.114   3.440   0.068  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.557   2.674   1.187  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.050   1.217   1.220  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.279   0.313   1.534  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.871   3.401   2.505  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.796   3.226   3.558  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.742   2.051   4.335  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.836   4.240   3.749  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.743   1.897   5.317  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.837   4.088   4.726  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.793   2.923   5.516  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.148   2.813   6.496  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.583   4.306   0.272  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.473   2.651   1.067  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.978   4.449   2.299  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.828   3.055   2.899  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.469   1.267   4.176  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.865   5.144   3.155  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.699   0.996   5.909  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.106   4.866   4.894  1.00  0.00           H  
+ATOM     56  HH  TYR A   3      -0.189   2.359   7.268  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.316   0.983   0.838  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.917  -0.354   0.736  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.164  -1.204  -0.302  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.740  -2.313   0.009  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.431  -0.260   0.419  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.188   0.682   1.392  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.073  -1.658   0.464  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.662   1.967   0.703  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.883   1.784   0.606  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.806  -0.849   1.701  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.550   0.118  -0.599  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.043   0.163   1.781  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.554   0.946   2.240  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.627  -2.311  -0.285  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.939  -2.102   1.451  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.141  -1.582   0.251  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.826   2.470   0.218  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.419   1.723  -0.045  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.102   2.636   1.442  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.951  -0.669  -1.512  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.159  -1.301  -2.575  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.710  -1.563  -2.137  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.195  -2.659  -2.357  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.205  -0.425  -3.844  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.431  -0.707  -4.723  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.229  -1.914  -5.660  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.748  -2.967  -5.270  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.591  -1.783  -6.912  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.269   0.277  -1.662  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.597  -2.273  -2.805  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.227   0.606  -3.547  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.305  -0.586  -4.439  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -6.272  -0.904  -4.086  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.620   0.176  -5.336  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -6.009  -0.948  -7.281  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.424  -2.601  -7.488  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.061  -0.590  -1.483  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.707  -0.761  -0.942  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.625  -1.886   0.103  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.254  -2.748   0.014  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.203   0.570  -0.378  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.188   0.516   0.176  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.328   0.543  -0.554  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.611   0.411   1.571  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.420   0.431   0.286  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.036   0.358   1.604  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.941   0.370   2.813  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.764   0.276   2.797  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.660   0.285   4.021  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.067   0.241   4.016  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.536   0.304  -1.365  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.047  -1.048  -1.761  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.223   1.298  -1.166  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.876   0.904   0.412  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.371   0.637  -1.631  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.399   0.438  -0.005  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.139   0.419   2.832  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.843   0.240   2.765  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.130   0.269   4.964  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.612   0.191   4.946  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.566  -1.931   1.058  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.690  -3.054   1.991  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.955  -4.378   1.260  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.318  -5.376   1.595  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.786  -2.777   3.037  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.391  -1.764   4.129  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.612  -1.492   5.013  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.258  -2.274   5.027  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.249  -1.176   1.107  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.737  -3.180   2.499  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.649  -2.397   2.525  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -3.042  -3.717   3.527  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.078  -0.829   3.669  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.419  -1.078   4.410  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.953  -2.420   5.476  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.357  -0.782   5.798  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.530  -3.234   5.465  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.339  -2.386   4.455  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.069  -1.559   5.827  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.824  -4.393   0.234  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.130  -5.587  -0.573  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.901  -6.192  -1.263  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.908  -7.378  -1.579  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.203  -5.259  -1.628  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.048  -6.490  -2.013  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.129  -6.766  -3.523  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -3.903  -7.532  -4.050  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -2.952  -6.665  -4.790  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.348  -3.538   0.053  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.517  -6.346   0.108  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.855  -4.504  -1.233  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.725  -4.833  -2.511  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.619  -7.352  -1.538  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.060  -6.319  -1.647  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.009  -7.348  -3.720  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.287  -5.837  -4.075  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -3.389  -7.970  -3.216  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -4.260  -8.327  -4.710  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -3.417  -6.219  -5.569  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -2.573  -5.948  -4.185  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -2.177  -7.215  -5.141  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.868  -5.389  -1.528  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.415  -5.850  -2.062  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.361  -6.433  -0.997  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.393  -7.000  -1.356  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.128  -4.679  -2.755  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.821  -5.147  -4.033  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.092  -5.500  -4.985  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.071  -5.076  -4.089  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.983  -4.400  -1.335  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.222  -6.632  -2.802  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.407  -3.924  -3.002  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.858  -4.239  -2.072  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.065  -6.245   0.295  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.887  -6.698   1.422  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.425  -5.583   2.330  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.181  -5.881   3.256  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.187  -5.780   0.519  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.284  -7.365   2.037  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.742  -7.268   1.059  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.061  -4.312   2.104  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.490  -3.202   2.957  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.026  -3.036   2.995  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.652  -3.007   1.932  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.472  -4.098   1.305  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.054  -2.278   2.582  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.093  -3.382   3.955  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.674  -2.922   4.179  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.124  -2.708   4.301  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.022  -3.877   3.833  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.218  -3.871   4.113  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.391  -2.376   5.780  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.023  -2.264   6.447  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.073  -2.998   5.504  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.387  -1.837   3.703  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.965  -3.158   6.239  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       6.935  -1.434   5.867  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.033  -2.731   7.413  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       4.734  -1.214   6.511  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.967  -4.022   5.806  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.094  -2.523   5.547  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.477  -4.893   3.152  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.175  -6.119   2.726  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.263  -6.275   1.201  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.639  -7.338   0.711  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.505  -7.331   3.383  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.754  -7.284   4.773  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.498  -4.804   2.901  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.208  -6.093   3.078  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.448  -7.301   3.204  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.916  -8.258   2.983  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.699  -6.365   5.049  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.946  -5.213   0.448  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.719  -5.256  -1.005  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.679  -4.357  -1.805  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.475  -4.156  -3.000  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.251  -4.902  -1.299  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.376  -5.610  -0.441  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.585  -4.411   0.948  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.876  -6.275  -1.359  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.108  -3.848  -1.154  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.023  -5.134  -2.341  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.677  -6.081  -0.956  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.709  -3.785  -1.159  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.714  -2.925  -1.800  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.190  -1.564  -2.282  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.812  -0.954  -3.149  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.834  -4.046  -0.191  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.523  -2.738  -1.093  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.138  -3.448  -2.658  1.00  0.00           H  
+ATOM    227  N   ARG A  16       8.055  -1.092  -1.742  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.352   0.126  -2.173  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.879   0.975  -0.975  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.283   0.422  -0.047  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.179  -0.250  -3.105  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.216  -1.290  -2.506  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       3.913  -1.453  -3.294  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.979  -2.564  -4.251  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       4.099  -2.562  -5.568  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       4.326  -1.471  -6.261  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       3.956  -3.703  -6.191  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.635  -1.646  -1.010  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.053   0.718  -2.760  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.622   0.641  -3.323  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       6.585  -0.650  -4.035  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.716  -2.239  -2.480  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.938  -1.000  -1.497  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       3.113  -1.638  -2.604  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.642  -0.518  -3.782  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.778  -3.506  -3.901  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.431  -0.607  -5.761  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       4.393  -1.513  -7.260  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       3.656  -4.483  -5.580  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.997  -3.809  -7.186  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.088   2.308  -0.976  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.623   3.182   0.103  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.085   3.329   0.103  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.453   3.095  -0.930  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.322   4.523  -0.149  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.496   4.553  -1.666  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.747   3.086  -2.015  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.949   2.777   1.062  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.713   5.342   0.184  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.304   4.513   0.328  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.610   4.918  -2.148  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.331   5.187  -1.966  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.329   2.855  -2.976  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.819   2.881  -1.995  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.472   3.730   1.236  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.027   3.921   1.331  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.560   5.180   0.573  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.278   6.182   0.545  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.729   4.033   2.829  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.024   4.603   3.406  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.103   3.976   2.524  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.530   3.041   0.935  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.904   4.696   3.008  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.555   3.040   3.241  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.040   5.673   3.332  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.152   4.336   4.455  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.931   4.649   2.412  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.423   3.028   2.956  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.350   5.165  -0.019  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.784   6.306  -0.729  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.140   7.315   0.240  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.739   6.964   1.032  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.244   5.698  -1.684  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.754   4.477  -0.918  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.472   4.010  -0.137  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.559   6.806  -1.311  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.041   6.389  -1.882  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.259   5.368  -2.595  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.552   4.747  -0.254  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.111   3.700  -1.593  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.182   3.664   0.836  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.986   3.234  -0.702  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.543   8.582   0.113  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.016   9.748   0.833  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.159  10.912  -0.134  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.277  11.467  -0.133  1.00  0.00           O  
+ATOM    297  CB  SER A  20       0.963  10.142   1.970  1.00  0.00           C  
+ATOM    298  OG  SER A  20       0.800   9.241   3.044  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.816  11.191  -0.866  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.245   8.811  -0.579  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.972   9.534   1.233  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.977  10.105   1.621  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.729  11.154   2.307  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -0.132   9.020   3.102  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       35                                                                  
+ATOM      1  N   ASN A   1      -5.868   7.107   0.465  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.755   6.451  -0.528  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.147   5.130  -1.011  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.599   4.083  -0.564  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.175   7.413  -1.661  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -8.572   7.064  -2.164  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.793   5.981  -2.676  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -9.552   7.938  -2.002  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.629   6.454   1.200  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.021   7.437   0.025  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.346   7.894   0.882  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.671   6.165  -0.007  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -7.174   8.419  -1.289  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.479   7.362  -2.498  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -9.433   8.852  -1.600  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -10.445   7.627  -2.351  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.067   5.159  -1.809  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.393   3.972  -2.370  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -3.815   2.986  -1.322  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.405   1.881  -1.670  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.318   4.475  -3.359  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -2.775   3.391  -4.321  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -2.886   3.852  -5.776  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -1.305   3.059  -4.036  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.731   6.044  -2.158  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.136   3.416  -2.944  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.747   5.262  -3.949  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.496   4.924  -2.803  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.366   2.482  -4.221  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.924   4.091  -6.007  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.264   4.732  -5.945  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -2.567   3.048  -6.440  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -0.682   3.941  -4.189  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.195   2.711  -3.010  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -0.974   2.268  -4.708  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -3.811   3.352  -0.033  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.274   2.565   1.082  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.871   1.151   1.162  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.162   0.203   1.485  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.498   3.331   2.395  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.474   3.026   3.471  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.556   1.845   4.232  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.445   3.950   3.728  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.614   1.596   5.250  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.515   3.719   4.759  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.602   2.538   5.524  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.272   2.308   6.543  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.199   4.255   0.180  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.199   2.466   0.933  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.461   4.382   2.183  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.496   3.115   2.779  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.347   1.135   4.044  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.383   4.866   3.163  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.662   0.704   5.850  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.238   4.465   4.970  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.748   3.106   6.781  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.156   0.994   0.814  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.850  -0.301   0.744  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.166  -1.221  -0.284  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.867  -2.383   0.001  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.341  -0.069   0.393  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.074   0.816   1.434  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.093  -1.407   0.261  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -9.121   1.725   0.775  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.666   1.828   0.551  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.792  -0.788   1.718  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.379   0.436  -0.575  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.565   0.180   2.146  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.376   1.460   1.967  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.735  -1.962  -0.606  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.943  -2.009   1.159  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.159  -1.227   0.131  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.623   2.466   0.151  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.802   1.138   0.157  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -9.693   2.241   1.546  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.893  -0.684  -1.479  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.220  -1.377  -2.577  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.743  -1.658  -2.245  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.248  -2.748  -2.519  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.380  -0.533  -3.859  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -4.875  -1.373  -5.046  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.310  -0.493  -6.218  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -4.652   0.465  -6.592  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -6.447  -0.772  -6.830  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.079   0.301  -1.598  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.712  -2.339  -2.718  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -5.088   0.251  -3.671  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.433  -0.060  -4.120  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -4.081  -2.018  -5.371  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -5.728  -1.974  -4.725  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.033  -1.546  -6.574  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.664  -0.145  -7.586  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.061  -0.708  -1.593  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.699  -0.882  -1.080  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.600  -1.986  -0.008  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.299  -2.830  -0.069  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.198   0.465  -0.550  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.182   0.437   0.022  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.329   0.427  -0.694  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.580   0.373   1.425  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.407   0.351   0.167  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.005   0.332   1.482  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.886   0.337   2.656  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.709   0.283   2.693  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.584   0.265   3.877  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.991   0.248   3.900  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.532   0.184  -1.455  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.054  -1.185  -1.905  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.210   1.168  -1.360  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.877   0.814   0.226  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.391   0.455  -1.774  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.385   0.314  -0.130  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.194   0.363   2.653  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.789   0.251   2.682  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.036   0.230   4.808  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.515   0.202   4.842  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.541  -2.027   0.949  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.640  -3.112   1.929  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.889  -4.468   1.261  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.238  -5.436   1.646  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.740  -2.826   2.968  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.343  -1.833   4.074  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.572  -1.572   4.953  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.217  -2.363   4.972  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.224  -1.274   0.990  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.682  -3.200   2.437  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.591  -2.427   2.451  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -3.015  -3.766   3.448  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.019  -0.896   3.626  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.372  -1.143   4.348  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.920  -2.504   5.398  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.325  -0.876   5.753  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.486  -3.340   5.377  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.290  -2.450   4.406  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.040  -1.673   5.795  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.770  -4.540   0.248  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.034  -5.773  -0.517  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.772  -6.426  -1.091  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.728  -7.650  -1.174  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.047  -5.506  -1.649  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.490  -5.877  -1.287  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.698  -7.403  -1.249  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.160  -7.768  -0.972  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.019  -7.558  -2.161  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.298  -3.699   0.023  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.441  -6.510   0.174  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.017  -4.461  -1.891  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.763  -6.070  -2.541  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.721  -5.471  -0.321  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -6.147  -5.448  -2.044  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.409  -7.817  -2.196  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.085  -7.829  -0.456  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -7.211  -8.801  -0.686  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.517  -7.163  -0.132  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.967  -6.595  -2.466  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.713  -8.153  -2.920  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -8.983  -7.781  -1.944  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.765  -5.631  -1.463  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.519  -6.121  -1.972  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.445  -6.678  -0.865  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.350  -7.452  -1.161  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.192  -4.971  -2.744  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.106  -5.477  -3.863  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       1.541  -5.942  -4.878  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       3.339  -5.352  -3.715  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.913  -4.632  -1.417  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.324  -6.932  -2.676  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.429  -4.352  -3.175  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.743  -4.334  -2.055  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.199  -6.324   0.409  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.035  -6.695   1.561  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.549  -5.516   2.405  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.396  -5.721   3.280  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.336  -5.822   0.592  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.449  -7.339   2.217  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.902  -7.263   1.226  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.066  -4.289   2.167  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.482  -3.079   2.879  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.013  -2.881   2.908  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.621  -2.749   1.846  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.409  -4.178   1.404  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.044  -2.219   2.376  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.076  -3.118   3.887  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.676  -2.846   4.086  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.134  -2.696   4.170  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.928  -3.774   3.419  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.047  -3.516   2.983  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.477  -2.732   5.665  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.171  -2.350   6.354  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.103  -2.919   5.422  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.404  -1.720   3.765  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.791  -3.715   5.961  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.280  -2.035   5.906  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.107  -2.794   7.329  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.083  -1.262   6.389  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       3.883  -3.937   5.681  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.191  -2.329   5.510  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.360  -4.977   3.249  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.010  -6.099   2.562  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.911  -6.017   1.027  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.428  -6.898   0.345  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.444  -7.423   3.092  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.672  -7.521   4.489  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.417  -5.134   3.594  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.075  -6.080   2.799  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.389  -7.461   2.900  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.937  -8.259   2.596  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.611  -7.422   4.660  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.292  -4.962   0.480  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.048  -4.754  -0.957  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.176  -4.018  -1.697  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.059  -3.747  -2.892  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.777  -3.919  -1.127  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.709  -4.470  -0.389  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.828  -4.305   1.101  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.888  -5.719  -1.440  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.964  -2.920  -0.782  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.508  -3.877  -2.181  1.00  0.00           H  
+ATOM    219  HG  SER A  14       2.926  -3.939  -0.562  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.243  -3.596  -1.007  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.361  -2.835  -1.585  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.056  -1.352  -1.859  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.930  -0.509  -1.670  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.265  -3.821  -0.022  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.215  -2.889  -0.911  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.653  -3.296  -2.529  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.831  -1.015  -2.290  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.367   0.368  -2.493  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.877   0.999  -1.170  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.119   0.344  -0.451  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.250   0.369  -3.554  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.874   1.792  -3.992  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.768   1.802  -5.052  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.592   3.152  -5.624  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.342   3.725  -6.562  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.353   3.099  -7.118  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       5.089   4.951  -6.960  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.202  -1.790  -2.478  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.215   0.937  -2.874  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.587  -0.180  -4.412  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.369  -0.141  -3.162  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.534   2.339  -3.134  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.762   2.274  -4.401  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.029   1.120  -5.838  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.833   1.483  -4.587  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       3.843   3.705  -5.240  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       6.545   2.161  -6.819  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       6.918   3.536  -7.824  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       4.328   5.470  -6.560  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       5.659   5.373  -7.669  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.221   2.269  -0.859  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.705   2.983   0.318  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.183   3.245   0.249  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.594   3.146  -0.833  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.498   4.298   0.370  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.885   4.544  -1.084  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.134   3.131  -1.601  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.917   2.397   1.214  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.889   5.098   0.744  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.399   4.155   0.967  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.088   5.020  -1.623  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.772   5.172  -1.170  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.928   3.076  -2.653  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.163   2.835  -1.385  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.535   3.602   1.379  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.098   3.869   1.415  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.719   5.165   0.669  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.544   6.071   0.542  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.731   3.957   2.902  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.030   4.415   3.560  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.106   3.739   2.712  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.577   3.026   0.967  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.947   4.671   3.062  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.465   2.968   3.271  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.125   5.483   3.523  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.086   4.106   4.605  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       5.991   4.345   2.679  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.326   2.749   3.115  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.459   5.284   0.203  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.978   6.448  -0.545  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.572   7.643   0.336  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.552   8.771  -0.151  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.242   5.929  -1.311  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.801   4.845  -0.388  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.449   4.236   0.235  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.734   6.784  -1.254  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.960   6.711  -1.465  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.084   5.476  -2.248  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.437   5.271   0.364  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.352   4.094  -0.947  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.254   3.936   1.246  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.782   3.395  -0.374  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.203   7.390   1.598  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.287   8.373   2.572  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.081   7.848   3.993  1.00  0.00           C  
+ATOM    296  O   SER A  20      -0.913   6.978   4.355  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.774   8.674   2.311  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -2.506   7.508   2.636  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.876   8.292   4.654  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.248   6.431   1.907  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.288   9.295   2.477  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.096   9.492   2.926  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.935   8.957   1.270  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.946   7.163   3.425  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       36                                                                  
+ATOM      1  N   ASN A   1      -8.345   5.007   0.601  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -8.415   4.187  -0.632  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -7.045   3.669  -1.059  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -6.816   2.479  -0.901  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -9.197   4.893  -1.758  1.00  0.00           C  
+ATOM      6  CG  ASN A   1     -10.643   5.166  -1.337  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1     -10.996   4.994  -0.179  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1     -11.503   5.612  -2.232  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -7.873   4.502   1.338  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -7.870   5.880   0.423  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -9.297   5.207   0.895  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.987   3.291  -0.382  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.717   5.825  -1.987  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -9.208   4.248  -2.640  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1     -11.263   5.791  -3.194  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1     -12.436   5.760  -1.880  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -6.121   4.518  -1.533  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.809   4.093  -2.051  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.031   3.175  -1.085  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.434   2.185  -1.506  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.963   5.337  -2.400  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.300   6.102  -3.694  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -4.155   5.211  -4.929  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -5.687   6.754  -3.691  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -6.348   5.491  -1.680  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -4.967   3.507  -2.957  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -4.062   6.029  -1.586  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.931   5.009  -2.510  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -3.568   6.906  -3.783  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -3.189   4.708  -4.910  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -4.950   4.465  -4.963  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.210   5.824  -5.829  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -6.467   5.996  -3.738  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -5.803   7.376  -2.804  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.778   7.392  -4.570  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.080   3.473   0.219  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.443   2.669   1.265  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -3.970   1.221   1.326  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.220   0.316   1.685  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.618   3.386   2.614  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.451   3.202   3.563  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.336   2.022   4.319  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -1.484   4.220   3.700  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.266   1.859   5.218  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -0.422   4.070   4.610  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.314   2.887   5.374  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.689   2.738   6.281  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.533   4.332   0.484  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.376   2.623   1.045  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -3.738   4.435   2.426  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.533   3.034   3.097  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.073   1.242   4.208  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -1.561   5.130   3.117  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.168   0.961   5.808  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3       0.304   4.861   4.721  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.122   3.570   6.477  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.233   0.982   0.940  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.848  -0.352   0.877  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.163  -1.178  -0.214  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.701  -2.283   0.059  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.377  -0.269   0.636  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.108   0.711   1.586  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -8.024  -1.663   0.703  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.003   0.381   3.081  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.759   1.748   0.533  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.674  -0.861   1.826  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.542   0.099  -0.378  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -7.695   1.690   1.433  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -9.164   0.739   1.316  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.622  -2.307  -0.080  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.834  -2.127   1.670  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.101  -1.579   0.552  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -8.525  -0.550   3.300  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -6.959   0.295   3.382  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.466   1.184   3.656  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -5.052  -0.619  -1.428  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.299  -1.207  -2.540  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.854  -1.505  -2.123  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.421  -2.646  -2.248  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.364  -0.280  -3.767  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.703  -0.407  -4.512  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.997   0.832  -5.354  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.747   1.710  -4.957  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.409   0.958  -6.528  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.422   0.315  -1.546  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.752  -2.163  -2.806  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.243   0.735  -3.441  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.560  -0.532  -4.460  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.663  -1.264  -5.156  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.516  -0.529  -3.797  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -4.765   0.277  -6.894  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -5.664   1.794  -7.028  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.139  -0.521  -1.559  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.764  -0.708  -1.080  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.621  -1.821  -0.023  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.282  -2.655  -0.123  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.226   0.624  -0.556  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.177   0.552  -0.041  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.291   0.506  -0.805  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.636   0.472   1.346  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.401   0.391   0.008  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.059   0.386   1.338  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       1.004   0.469   2.607  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.822   0.325   2.511  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.758   0.393   3.795  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.163   0.337   3.750  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.566   0.400  -1.493  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.148  -1.012  -1.929  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.256   1.338  -1.356  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.872   0.979   0.246  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.305   0.538  -1.888  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.371   0.349  -0.315  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.074   0.535   2.657  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.900   0.268   2.446  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.258   0.397   4.753  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.733   0.301   4.667  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.520  -1.885   0.971  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.546  -3.008   1.915  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.821  -4.345   1.210  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.199  -5.346   1.565  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.568  -2.758   3.038  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.110  -1.733   4.094  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.291  -1.398   5.011  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -0.966  -2.250   4.977  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.224  -1.155   1.053  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.553  -3.100   2.352  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.476  -2.399   2.593  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.769  -3.700   3.549  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.780  -0.823   3.598  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.097  -0.955   4.426  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.659  -2.303   5.495  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.979  -0.690   5.779  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.320  -3.059   5.617  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.139  -2.614   4.372  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.594  -1.440   5.602  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.683  -4.366   0.182  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.015  -5.563  -0.608  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.848  -6.159  -1.409  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.978  -7.286  -1.891  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.151  -5.246  -1.594  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.168  -6.394  -1.663  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -5.900  -6.429  -3.012  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -5.280  -7.448  -3.983  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -3.846  -7.183  -4.280  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.170  -3.498  -0.036  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.348  -6.330   0.093  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.653  -4.353  -1.273  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.719  -5.054  -2.577  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -4.651  -7.324  -1.524  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.894  -6.248  -0.863  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.926  -6.694  -2.842  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -5.919  -5.435  -3.463  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.363  -8.426  -3.549  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -5.865  -7.435  -4.907  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -3.724  -6.252  -4.654  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -3.274  -7.269  -3.437  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -3.500  -7.847  -4.959  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.761  -5.409  -1.606  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.518  -5.887  -2.146  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.477  -6.413  -1.062  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.507  -6.993  -1.402  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.203  -4.746  -2.916  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       0.565  -4.528  -4.288  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       0.935  -5.288  -5.208  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9      -0.287  -3.621  -4.405  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.838  -4.424  -1.369  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.340  -6.709  -2.843  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       1.118  -3.841  -2.345  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       2.251  -4.998  -3.073  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.166  -6.210   0.226  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.990  -6.622   1.367  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.542  -5.464   2.208  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.334  -5.711   3.115  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.272  -5.773   0.437  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.386  -7.249   2.021  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.837  -7.217   1.024  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.159  -4.210   1.925  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.661  -3.046   2.655  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.200  -2.979   2.631  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.782  -3.116   1.550  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.535  -4.045   1.144  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.267  -2.143   2.192  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.290  -3.099   3.676  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.884  -2.799   3.785  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.347  -2.733   3.841  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.047  -3.937   3.195  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.110  -3.775   2.595  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.717  -2.624   5.327  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.445  -2.101   5.991  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.334  -2.698   5.130  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.671  -1.826   3.329  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       6.987  -3.584   5.724  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.555  -1.942   5.483  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.372  -2.442   7.006  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.418  -1.013   5.926  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.059  -3.669   5.495  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.452  -2.058   5.170  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.446  -5.136   3.263  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.011  -6.363   2.690  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.149  -6.316   1.165  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.983  -7.035   0.623  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.153  -7.573   3.073  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.053  -7.692   4.480  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.546  -5.219   3.725  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.010  -6.507   3.102  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.170  -7.453   2.659  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.605  -8.481   2.668  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.911  -7.936   4.835  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.381  -5.460   0.473  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.506  -5.250  -0.977  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.628  -4.264  -1.351  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.865  -4.012  -2.530  1.00  0.00           O  
+ATOM    213  CB  SER A  14       5.167  -4.770  -1.558  1.00  0.00           C  
+ATOM    214  OG  SER A  14       4.894  -5.465  -2.757  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.734  -4.866   0.986  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.748  -6.210  -1.440  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.383  -4.958  -0.850  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       5.209  -3.700  -1.766  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.943  -5.622  -2.814  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.305  -3.650  -0.369  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.425  -2.723  -0.566  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.041  -1.328  -1.080  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.718  -0.356  -0.750  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.061  -3.868   0.595  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15       9.946  -2.602   0.385  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15      10.124  -3.163  -1.277  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.963  -1.202  -1.869  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.437   0.089  -2.339  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.901   0.917  -1.155  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.143   0.369  -0.352  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.345  -0.153  -3.399  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       6.052   1.130  -4.193  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       5.045   0.908  -5.333  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       5.431   1.681  -6.532  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       5.978   1.218  -7.653  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       6.157  -0.064  -7.871  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       6.370   2.053  -8.588  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.514  -2.068  -2.147  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.272   0.615  -2.801  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.677  -0.916  -4.076  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.432  -0.513  -2.923  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.653   1.865  -3.521  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.992   1.485  -4.616  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       5.018  -0.136  -5.581  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       4.058   1.230  -4.997  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.320   2.679  -6.467  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       5.847  -0.713  -7.171  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       6.562  -0.400  -8.725  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       6.273   3.046  -8.463  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       6.787   1.699  -9.428  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.223   2.224  -1.040  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.725   3.069   0.048  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.198   3.267  -0.012  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.600   3.082  -1.075  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.472   4.402  -0.100  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.803   4.461  -1.589  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.084   2.999  -1.923  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       6.988   2.611   1.003  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.847   5.226   0.187  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.397   4.366   0.477  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.973   4.836  -2.156  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.662   5.098  -1.791  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.847   2.797  -2.950  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.128   2.763  -1.708  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.558   3.663   1.109  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.118   3.895   1.157  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.704   5.139   0.350  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.494   6.075   0.206  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.775   4.055   2.641  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.071   4.582   3.251  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.151   3.896   2.419  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.608   3.020   0.760  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       1.974   4.756   2.776  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.543   3.080   3.070  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.134   5.649   3.159  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.154   4.332   4.308  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.013   4.529   2.331  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.412   2.939   2.872  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.454   5.184  -0.142  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.910   6.335  -0.849  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.561   7.461   0.136  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.109   7.228   1.144  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.325   5.804  -1.578  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.816   4.675  -0.671  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.464   4.121  -0.057  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.631   6.703  -1.581  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.071   6.569  -1.676  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19      -0.024   5.388  -2.541  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.472   5.053   0.089  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.335   3.905  -1.236  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.297   3.850   0.968  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.811   3.272  -0.645  1.00  0.00           H  
+ATOM    293  N   SER A  20       1.026   8.673  -0.178  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.698   9.933   0.494  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.638  10.528   0.034  1.00  0.00           C  
+ATOM    296  O   SER A  20      -1.052  10.270  -1.120  1.00  0.00           O  
+ATOM    297  CB  SER A  20       1.845  10.928   0.290  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.324  10.900  -1.046  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.231  11.239   0.875  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.554   8.807  -1.028  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.586   9.752   1.561  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       1.493  11.917   0.514  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       2.664  10.654   0.959  1.00  0.00           H  
+ATOM    304  HG  SER A  20       2.939  11.625  -1.177  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       37                                                                  
+ATOM      1  N   ASN A   1      -5.798   7.479   0.401  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -6.588   7.022  -0.767  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.199   5.613  -1.207  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.021   4.713  -1.096  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -6.557   8.030  -1.932  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -7.956   8.586  -2.147  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -8.343   9.541  -1.498  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -8.767   7.973  -2.991  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -5.816   6.777   1.127  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -4.838   7.655   0.131  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.193   8.335   0.767  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -7.627   6.938  -0.443  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -5.884   8.832  -1.696  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -6.214   7.562  -2.856  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -8.509   7.171  -3.541  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -9.676   8.400  -3.071  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -4.963   5.401  -1.676  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.527   4.127  -2.262  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.002   3.108  -1.223  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.490   2.051  -1.588  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.515   4.448  -3.386  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -3.518   3.386  -4.508  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.924   3.985  -5.857  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -2.165   2.687  -4.652  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -4.310   6.167  -1.771  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.403   3.668  -2.726  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.766   5.400  -3.813  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -2.516   4.554  -2.964  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -4.262   2.639  -4.267  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.932   4.396  -5.784  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -3.228   4.767  -6.155  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -3.936   3.199  -6.614  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -1.412   3.394  -5.001  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -1.857   2.272  -3.692  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -2.253   1.872  -5.370  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.143   3.405   0.077  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.594   2.622   1.192  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.041   1.158   1.165  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.239   0.261   1.408  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -3.976   3.276   2.532  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.857   3.224   3.553  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -2.508   2.017   4.182  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -2.132   4.392   3.837  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -1.412   1.972   5.068  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -1.039   4.360   4.722  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.662   3.140   5.323  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.439   3.086   6.118  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.628   4.258   0.296  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.507   2.635   1.105  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.228   4.303   2.352  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.863   2.793   2.949  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -3.069   1.122   3.968  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -2.417   5.309   3.354  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3      -1.123   1.050   5.550  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -0.485   5.260   4.942  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       0.954   3.895   6.046  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.313   0.913   0.819  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.875  -0.433   0.687  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -5.150  -1.213  -0.419  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.782  -2.367  -0.218  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.404  -0.376   0.441  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.133   0.538   1.461  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.996  -1.794   0.489  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.579   1.867   0.834  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.909   1.712   0.664  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.703  -0.963   1.625  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.582   0.014  -0.564  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -8.999   0.022   1.830  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.484   0.744   2.314  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.610  -2.395  -0.333  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.734  -2.278   1.431  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -9.082  -1.752   0.406  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.781   2.293   0.225  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.456   1.698   0.209  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.839   2.575   1.623  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.916  -0.587  -1.582  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -4.177  -1.207  -2.684  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.695  -1.416  -2.351  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -2.131  -2.431  -2.746  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -4.323  -0.379  -3.966  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -5.742  -0.393  -4.567  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -6.425   0.974  -4.548  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -6.408   1.714  -5.514  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -7.071   1.361  -3.464  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.081   0.408  -1.625  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.585  -2.193  -2.872  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.062   0.637  -3.742  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.636  -0.777  -4.715  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -5.677  -0.726  -5.585  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -6.369  -1.116  -4.046  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -7.192   0.797  -2.646  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -7.525   2.252  -3.586  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -2.077  -0.504  -1.595  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.720  -0.701  -1.084  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.636  -1.874  -0.089  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.249  -2.721  -0.206  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.212   0.612  -0.482  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.182   0.533   0.054  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.314   0.521  -0.685  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.608   0.404   1.443  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.408   0.380   0.147  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       3.031   0.317   1.470  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.937   0.364   2.685  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.755   0.214   2.665  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.654   0.247   3.892  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       3.057   0.179   3.883  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.581   0.349  -1.361  1.00  0.00           H  
+ATOM    108  HA  TRP A   6      -0.070  -0.958  -1.922  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.239   1.366  -1.245  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.876   0.919   0.324  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.354   0.591  -1.764  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.380   0.346  -0.171  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.140   0.441   2.699  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.832   0.162   2.632  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       1.123   0.229   4.833  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.599   0.110   4.815  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.578  -1.972   0.862  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.635  -3.091   1.807  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.938  -4.442   1.140  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.409  -5.445   1.613  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.649  -2.806   2.929  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.162  -1.784   3.974  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.325  -1.421   4.903  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.020  -2.318   4.848  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.263  -1.224   0.945  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.647  -3.201   2.250  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.548  -2.428   2.482  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.870  -3.739   3.450  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -1.826  -0.882   3.469  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.144  -0.999   4.320  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.677  -2.310   5.426  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -2.996  -0.686   5.638  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.350  -3.197   5.402  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.162  -2.584   4.235  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -0.705  -1.549   5.553  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.727  -4.482   0.050  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.029  -5.712  -0.710  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.781  -6.486  -1.146  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.824  -7.713  -1.157  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -3.877  -5.403  -1.959  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -5.382  -5.303  -1.680  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.121  -4.820  -2.936  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -7.604  -4.569  -2.640  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -8.094  -3.337  -3.303  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.183  -3.613  -0.220  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.587  -6.394  -0.066  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -3.547  -4.468  -2.369  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.735  -6.199  -2.691  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.755  -6.268  -1.398  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -5.561  -4.609  -0.862  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -5.672  -3.907  -3.278  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.030  -5.569  -3.726  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -8.176  -5.405  -2.994  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -7.739  -4.483  -1.558  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.671  -2.528  -2.870  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -7.852  -3.348  -4.286  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -9.100  -3.265  -3.217  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.706  -5.789  -1.524  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.553  -6.406  -1.949  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.294  -7.047  -0.758  1.00  0.00           C  
+ATOM    161  O   ASP A   9       1.606  -8.237  -0.786  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.394  -5.344  -2.675  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       2.486  -5.969  -3.549  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       3.523  -6.378  -2.986  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       2.263  -6.015  -4.778  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -0.768  -4.780  -1.507  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.326  -7.201  -2.662  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.747  -4.757  -3.298  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.836  -4.661  -1.952  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.509  -6.275   0.317  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       2.156  -6.749   1.545  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.683  -5.650   2.474  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.675  -5.864   3.179  1.00  0.00           O  
+ATOM    174  H   GLY A  10       1.256  -5.305   0.206  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.435  -7.344   2.107  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.991  -7.399   1.279  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.059  -4.463   2.477  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.499  -3.312   3.269  1.00  0.00           C  
+ATOM    179  C   GLY A  11       3.991  -2.994   3.056  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.434  -2.979   1.903  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.253  -4.352   1.879  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       1.923  -2.437   2.974  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.296  -3.527   4.316  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.793  -2.762   4.118  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.229  -2.487   3.995  1.00  0.00           C  
+ATOM    186  C   PRO A  12       7.028  -3.585   3.274  1.00  0.00           C  
+ATOM    187  O   PRO A  12       8.076  -3.294   2.700  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.752  -2.306   5.426  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.507  -2.017   6.260  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.401  -2.765   5.520  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.358  -1.552   3.450  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.237  -3.200   5.768  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.469  -1.487   5.487  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.620  -2.390   7.260  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.297  -0.947   6.247  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.322  -3.771   5.884  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.446  -2.266   5.679  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.542  -4.835   3.272  1.00  0.00           N  
+ATOM    199  CA  SER A  13       7.225  -5.960   2.613  1.00  0.00           C  
+ATOM    200  C   SER A  13       7.090  -5.923   1.084  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.812  -6.639   0.397  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.715  -7.304   3.143  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.868  -7.384   4.548  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.615  -5.000   3.652  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.289  -5.899   2.846  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.676  -7.407   2.896  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       7.295  -8.107   2.686  1.00  0.00           H  
+ATOM    208  HG  SER A  13       6.175  -6.863   4.961  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.215  -5.060   0.547  1.00  0.00           N  
+ATOM    210  CA  SER A  14       5.985  -4.853  -0.893  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.162  -4.169  -1.609  1.00  0.00           C  
+ATOM    212  O   SER A  14       7.144  -4.019  -2.829  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.753  -3.963  -1.131  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.717  -4.170  -0.195  1.00  0.00           O  
+ATOM    215  H   SER A  14       5.645  -4.521   1.187  1.00  0.00           H  
+ATOM    216  HA  SER A  14       5.802  -5.822  -1.361  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       5.060  -2.936  -1.075  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.378  -4.145  -2.137  1.00  0.00           H  
+ATOM    219  HG  SER A  14       3.940  -3.652   0.618  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.149  -3.648  -0.867  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.308  -2.922  -1.397  1.00  0.00           C  
+ATOM    222  C   GLY A  15       9.025  -1.456  -1.756  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.889  -0.604  -1.556  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.079  -3.767   0.134  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.105  -2.947  -0.656  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.666  -3.429  -2.292  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.825  -1.141  -2.266  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.373   0.232  -2.551  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.899   0.948  -1.262  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.146   0.343  -0.492  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       6.251   0.175  -3.606  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.730   1.567  -4.005  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.469   1.519  -4.875  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       4.763   1.758  -6.300  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       3.916   2.227  -7.208  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       2.658   2.472  -6.918  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       4.320   2.468  -8.433  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.201  -1.921  -2.440  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       8.223   0.770  -2.970  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       6.631  -0.312  -4.483  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       5.424  -0.414  -3.204  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       5.505   2.115  -3.110  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       6.516   2.126  -4.513  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.016   0.551  -4.774  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       3.800   2.303  -4.511  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       5.706   1.581  -6.603  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       2.347   2.274  -5.983  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.019   2.829  -7.604  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       5.274   2.298  -8.697  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       3.671   2.823  -9.112  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.238   2.239  -1.049  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.752   3.031   0.091  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.220   3.248   0.078  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.591   3.120  -0.974  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.502   4.368   0.005  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.850   4.499  -1.475  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       8.119   3.053  -1.878  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.029   2.523   1.014  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       6.875   5.179   0.323  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.421   4.310   0.590  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       7.030   4.911  -2.031  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.722   5.135  -1.635  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.895   2.907  -2.917  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       9.157   2.796  -1.662  1.00  0.00           H  
+ATOM    265  N   PRO A  18       4.609   3.598   1.230  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.169   3.836   1.328  1.00  0.00           C  
+ATOM    267  C   PRO A  18       2.742   5.156   0.656  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.546   6.084   0.554  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       2.862   3.850   2.829  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       4.166   4.332   3.459  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.241   3.765   2.532  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       2.644   3.006   0.861  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       2.058   4.525   3.049  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       2.652   2.837   3.167  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       4.207   5.404   3.483  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       4.282   3.964   4.478  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.067   4.446   2.460  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       5.572   2.793   2.901  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.469   5.271   0.226  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       0.934   6.477  -0.411  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.511   7.576   0.577  1.00  0.00           C  
+ATOM    282  O   PRO A  19       0.337   8.718   0.154  1.00  0.00           O  
+ATOM    283  CB  PRO A  19      -0.292   5.993  -1.191  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.802   4.823  -0.346  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       0.482   4.200   0.195  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       1.665   6.898  -1.103  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -1.032   6.767  -1.264  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.019   5.632  -2.172  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -1.428   5.170   0.453  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -1.362   4.109  -0.947  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.321   3.813   1.183  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       0.825   3.424  -0.490  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.305   7.237   1.858  1.00  0.00           N  
+ATOM    294  CA  SER A  20      -0.121   8.153   2.922  1.00  0.00           C  
+ATOM    295  C   SER A  20       0.633   7.935   4.225  1.00  0.00           C  
+ATOM    296  O   SER A  20       1.271   6.865   4.365  1.00  0.00           O  
+ATOM    297  CB  SER A  20      -1.606   7.996   3.229  1.00  0.00           C  
+ATOM    298  OG  SER A  20      -1.979   9.152   3.934  1.00  0.00           O  
+ATOM    299  OXT SER A  20       0.418   8.818   5.086  1.00  0.00           O  
+ATOM    300  H   SER A  20       0.556   6.306   2.160  1.00  0.00           H  
+ATOM    301  HA  SER A  20       0.065   9.179   2.607  1.00  0.00           H  
+ATOM    302  HB2 SER A  20      -2.169   7.916   2.319  1.00  0.00           H  
+ATOM    303  HB3 SER A  20      -1.742   7.145   3.893  1.00  0.00           H  
+ATOM    304  HG  SER A  20      -1.222   9.307   4.547  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MODEL       38                                                                  
+ATOM      1  N   ASN A   1      -6.430   7.268  -0.166  1.00  0.00           N  
+ATOM      2  CA  ASN A   1      -7.338   6.541  -1.083  1.00  0.00           C  
+ATOM      3  C   ASN A   1      -6.741   5.186  -1.487  1.00  0.00           C  
+ATOM      4  O   ASN A   1      -7.302   4.173  -1.103  1.00  0.00           O  
+ATOM      5  CB  ASN A   1      -7.816   7.420  -2.263  1.00  0.00           C  
+ATOM      6  CG  ASN A   1      -6.722   7.736  -3.278  1.00  0.00           C  
+ATOM      7  OD1 ASN A   1      -6.455   6.960  -4.175  1.00  0.00           O  
+ATOM      8  ND2 ASN A   1      -5.989   8.824  -3.136  1.00  0.00           N  
+ATOM      9  H1  ASN A   1      -6.139   6.658   0.586  1.00  0.00           H  
+ATOM     10  H2  ASN A   1      -5.611   7.592  -0.664  1.00  0.00           H  
+ATOM     11  H3  ASN A   1      -6.908   8.064   0.234  1.00  0.00           H  
+ATOM     12  HA  ASN A   1      -8.233   6.285  -0.514  1.00  0.00           H  
+ATOM     13  HB2 ASN A   1      -8.609   6.904  -2.770  1.00  0.00           H  
+ATOM     14  HB3 ASN A   1      -8.228   8.355  -1.876  1.00  0.00           H  
+ATOM     15 HD21 ASN A   1      -6.187   9.584  -2.506  1.00  0.00           H  
+ATOM     16 HD22 ASN A   1      -5.321   8.935  -3.885  1.00  0.00           H  
+ATOM     17  N   LEU A   2      -5.581   5.139  -2.154  1.00  0.00           N  
+ATOM     18  CA  LEU A   2      -4.935   3.924  -2.679  1.00  0.00           C  
+ATOM     19  C   LEU A   2      -4.238   3.028  -1.631  1.00  0.00           C  
+ATOM     20  O   LEU A   2      -3.619   2.024  -1.985  1.00  0.00           O  
+ATOM     21  CB  LEU A   2      -3.974   4.371  -3.806  1.00  0.00           C  
+ATOM     22  CG  LEU A   2      -4.642   4.256  -5.191  1.00  0.00           C  
+ATOM     23  CD1 LEU A   2      -3.992   5.215  -6.190  1.00  0.00           C  
+ATOM     24  CD2 LEU A   2      -4.527   2.822  -5.718  1.00  0.00           C  
+ATOM     25  H   LEU A   2      -5.206   6.000  -2.526  1.00  0.00           H  
+ATOM     26  HA  LEU A   2      -5.713   3.296  -3.117  1.00  0.00           H  
+ATOM     27  HB2 LEU A   2      -3.690   5.392  -3.639  1.00  0.00           H  
+ATOM     28  HB3 LEU A   2      -3.065   3.769  -3.800  1.00  0.00           H  
+ATOM     29  HG  LEU A   2      -5.698   4.515  -5.115  1.00  0.00           H  
+ATOM     30 HD11 LEU A   2      -4.204   6.242  -5.892  1.00  0.00           H  
+ATOM     31 HD12 LEU A   2      -2.915   5.058  -6.224  1.00  0.00           H  
+ATOM     32 HD13 LEU A   2      -4.414   5.054  -7.182  1.00  0.00           H  
+ATOM     33 HD21 LEU A   2      -3.478   2.549  -5.839  1.00  0.00           H  
+ATOM     34 HD22 LEU A   2      -4.998   2.131  -5.020  1.00  0.00           H  
+ATOM     35 HD23 LEU A   2      -5.031   2.745  -6.681  1.00  0.00           H  
+ATOM     36  N   TYR A   3      -4.360   3.359  -0.340  1.00  0.00           N  
+ATOM     37  CA  TYR A   3      -3.724   2.648   0.772  1.00  0.00           C  
+ATOM     38  C   TYR A   3      -4.137   1.169   0.856  1.00  0.00           C  
+ATOM     39  O   TYR A   3      -3.317   0.329   1.227  1.00  0.00           O  
+ATOM     40  CB  TYR A   3      -4.029   3.379   2.090  1.00  0.00           C  
+ATOM     41  CG  TYR A   3      -2.887   3.312   3.082  1.00  0.00           C  
+ATOM     42  CD1 TYR A   3      -1.861   4.274   3.013  1.00  0.00           C  
+ATOM     43  CD2 TYR A   3      -2.830   2.295   4.054  1.00  0.00           C  
+ATOM     44  CE1 TYR A   3      -0.765   4.215   3.892  1.00  0.00           C  
+ATOM     45  CE2 TYR A   3      -1.745   2.242   4.951  1.00  0.00           C  
+ATOM     46  CZ  TYR A   3      -0.706   3.197   4.866  1.00  0.00           C  
+ATOM     47  OH  TYR A   3       0.351   3.124   5.717  1.00  0.00           O  
+ATOM     48  H   TYR A   3      -4.937   4.156  -0.129  1.00  0.00           H  
+ATOM     49  HA  TYR A   3      -2.646   2.676   0.609  1.00  0.00           H  
+ATOM     50  HB2 TYR A   3      -4.231   4.410   1.870  1.00  0.00           H  
+ATOM     51  HB3 TYR A   3      -4.934   2.967   2.541  1.00  0.00           H  
+ATOM     52  HD1 TYR A   3      -1.912   5.069   2.285  1.00  0.00           H  
+ATOM     53  HD2 TYR A   3      -3.617   1.558   4.111  1.00  0.00           H  
+ATOM     54  HE1 TYR A   3       0.013   4.960   3.818  1.00  0.00           H  
+ATOM     55  HE2 TYR A   3      -1.685   1.473   5.706  1.00  0.00           H  
+ATOM     56  HH  TYR A   3       1.074   3.686   5.430  1.00  0.00           H  
+ATOM     57  N   ILE A   4      -5.379   0.841   0.456  1.00  0.00           N  
+ATOM     58  CA  ILE A   4      -5.867  -0.543   0.382  1.00  0.00           C  
+ATOM     59  C   ILE A   4      -4.972  -1.370  -0.545  1.00  0.00           C  
+ATOM     60  O   ILE A   4      -4.513  -2.431  -0.139  1.00  0.00           O  
+ATOM     61  CB  ILE A   4      -7.351  -0.631  -0.056  1.00  0.00           C  
+ATOM     62  CG1 ILE A   4      -8.267   0.276   0.803  1.00  0.00           C  
+ATOM     63  CG2 ILE A   4      -7.848  -2.085   0.043  1.00  0.00           C  
+ATOM     64  CD1 ILE A   4      -8.626   1.595   0.106  1.00  0.00           C  
+ATOM     65  H   ILE A   4      -5.992   1.589   0.165  1.00  0.00           H  
+ATOM     66  HA  ILE A   4      -5.785  -0.978   1.379  1.00  0.00           H  
+ATOM     67  HB  ILE A   4      -7.431  -0.341  -1.106  1.00  0.00           H  
+ATOM     68 HG12 ILE A   4      -9.174  -0.257   1.016  1.00  0.00           H  
+ATOM     69 HG13 ILE A   4      -7.782   0.492   1.756  1.00  0.00           H  
+ATOM     70 HG21 ILE A   4      -7.271  -2.734  -0.616  1.00  0.00           H  
+ATOM     71 HG22 ILE A   4      -7.761  -2.445   1.069  1.00  0.00           H  
+ATOM     72 HG23 ILE A   4      -8.892  -2.140  -0.270  1.00  0.00           H  
+ATOM     73 HD11 ILE A   4      -7.974   1.772  -0.749  1.00  0.00           H  
+ATOM     74 HD12 ILE A   4      -9.658   1.551  -0.248  1.00  0.00           H  
+ATOM     75 HD13 ILE A   4      -8.528   2.422   0.809  1.00  0.00           H  
+ATOM     76  N   GLN A   5      -4.692  -0.874  -1.757  1.00  0.00           N  
+ATOM     77  CA  GLN A   5      -3.867  -1.563  -2.751  1.00  0.00           C  
+ATOM     78  C   GLN A   5      -2.445  -1.809  -2.222  1.00  0.00           C  
+ATOM     79  O   GLN A   5      -1.929  -2.921  -2.330  1.00  0.00           O  
+ATOM     80  CB  GLN A   5      -3.847  -0.743  -4.058  1.00  0.00           C  
+ATOM     81  CG  GLN A   5      -3.727  -1.623  -5.311  1.00  0.00           C  
+ATOM     82  CD  GLN A   5      -5.084  -2.186  -5.734  1.00  0.00           C  
+ATOM     83  OE1 GLN A   5      -5.698  -2.984  -5.042  1.00  0.00           O  
+ATOM     84  NE2 GLN A   5      -5.615  -1.776  -6.871  1.00  0.00           N  
+ATOM     85  H   GLN A   5      -5.036   0.048  -1.986  1.00  0.00           H  
+ATOM     86  HA  GLN A   5      -4.323  -2.535  -2.945  1.00  0.00           H  
+ATOM     87  HB2 GLN A   5      -4.757  -0.178  -4.122  1.00  0.00           H  
+ATOM     88  HB3 GLN A   5      -3.011  -0.043  -4.034  1.00  0.00           H  
+ATOM     89  HG2 GLN A   5      -3.329  -1.033  -6.114  1.00  0.00           H  
+ATOM     90  HG3 GLN A   5      -3.035  -2.447  -5.128  1.00  0.00           H  
+ATOM     91 HE21 GLN A   5      -5.153  -1.128  -7.485  1.00  0.00           H  
+ATOM     92 HE22 GLN A   5      -6.510  -2.185  -7.079  1.00  0.00           H  
+ATOM     93  N   TRP A   6      -1.839  -0.788  -1.599  1.00  0.00           N  
+ATOM     94  CA  TRP A   6      -0.525  -0.892  -0.956  1.00  0.00           C  
+ATOM     95  C   TRP A   6      -0.505  -1.946   0.161  1.00  0.00           C  
+ATOM     96  O   TRP A   6       0.383  -2.798   0.180  1.00  0.00           O  
+ATOM     97  CB  TRP A   6      -0.095   0.486  -0.442  1.00  0.00           C  
+ATOM     98  CG  TRP A   6       1.244   0.517   0.231  1.00  0.00           C  
+ATOM     99  CD1 TRP A   6       2.442   0.440  -0.391  1.00  0.00           C  
+ATOM    100  CD2 TRP A   6       1.543   0.573   1.661  1.00  0.00           C  
+ATOM    101  NE1 TRP A   6       3.455   0.482   0.546  1.00  0.00           N  
+ATOM    102  CE2 TRP A   6       2.959   0.563   1.826  1.00  0.00           C  
+ATOM    103  CE3 TRP A   6       0.765   0.602   2.836  1.00  0.00           C  
+ATOM    104  CZ2 TRP A   6       3.578   0.610   3.082  1.00  0.00           C  
+ATOM    105  CZ3 TRP A   6       1.375   0.609   4.105  1.00  0.00           C  
+ATOM    106  CH2 TRP A   6       2.774   0.632   4.232  1.00  0.00           C  
+ATOM    107  H   TRP A   6      -2.350   0.086  -1.539  1.00  0.00           H  
+ATOM    108  HA  TRP A   6       0.198  -1.218  -1.705  1.00  0.00           H  
+ATOM    109  HB2 TRP A   6      -0.064   1.159  -1.277  1.00  0.00           H  
+ATOM    110  HB3 TRP A   6      -0.841   0.856   0.262  1.00  0.00           H  
+ATOM    111  HD1 TRP A   6       2.583   0.342  -1.457  1.00  0.00           H  
+ATOM    112  HE1 TRP A   6       4.453   0.438   0.329  1.00  0.00           H  
+ATOM    113  HE3 TRP A   6      -0.312   0.606   2.755  1.00  0.00           H  
+ATOM    114  HZ2 TRP A   6       4.655   0.607   3.156  1.00  0.00           H  
+ATOM    115  HZ3 TRP A   6       0.762   0.609   4.996  1.00  0.00           H  
+ATOM    116  HH2 TRP A   6       3.223   0.656   5.215  1.00  0.00           H  
+ATOM    117  N   LEU A   7      -1.495  -1.933   1.067  1.00  0.00           N  
+ATOM    118  CA  LEU A   7      -1.631  -2.979   2.085  1.00  0.00           C  
+ATOM    119  C   LEU A   7      -1.880  -4.365   1.470  1.00  0.00           C  
+ATOM    120  O   LEU A   7      -1.286  -5.334   1.938  1.00  0.00           O  
+ATOM    121  CB  LEU A   7      -2.736  -2.618   3.092  1.00  0.00           C  
+ATOM    122  CG  LEU A   7      -2.373  -1.484   4.072  1.00  0.00           C  
+ATOM    123  CD1 LEU A   7      -3.572  -1.205   4.981  1.00  0.00           C  
+ATOM    124  CD2 LEU A   7      -1.173  -1.831   4.963  1.00  0.00           C  
+ATOM    125  H   LEU A   7      -2.195  -1.196   1.019  1.00  0.00           H  
+ATOM    126  HA  LEU A   7      -0.684  -3.061   2.616  1.00  0.00           H  
+ATOM    127  HB2 LEU A   7      -3.605  -2.317   2.540  1.00  0.00           H  
+ATOM    128  HB3 LEU A   7      -2.968  -3.507   3.680  1.00  0.00           H  
+ATOM    129  HG  LEU A   7      -2.145  -0.578   3.513  1.00  0.00           H  
+ATOM    130 HD11 LEU A   7      -4.432  -0.914   4.377  1.00  0.00           H  
+ATOM    131 HD12 LEU A   7      -3.821  -2.097   5.558  1.00  0.00           H  
+ATOM    132 HD13 LEU A   7      -3.338  -0.395   5.671  1.00  0.00           H  
+ATOM    133 HD21 LEU A   7      -1.337  -2.790   5.456  1.00  0.00           H  
+ATOM    134 HD22 LEU A   7      -0.263  -1.882   4.367  1.00  0.00           H  
+ATOM    135 HD23 LEU A   7      -1.035  -1.059   5.719  1.00  0.00           H  
+ATOM    136  N   LYS A   8      -2.706  -4.471   0.416  1.00  0.00           N  
+ATOM    137  CA  LYS A   8      -3.040  -5.736  -0.258  1.00  0.00           C  
+ATOM    138  C   LYS A   8      -1.805  -6.466  -0.789  1.00  0.00           C  
+ATOM    139  O   LYS A   8      -1.742  -7.687  -0.688  1.00  0.00           O  
+ATOM    140  CB  LYS A   8      -4.034  -5.485  -1.410  1.00  0.00           C  
+ATOM    141  CG  LYS A   8      -4.931  -6.689  -1.757  1.00  0.00           C  
+ATOM    142  CD  LYS A   8      -6.238  -6.726  -0.944  1.00  0.00           C  
+ATOM    143  CE  LYS A   8      -6.111  -7.395   0.434  1.00  0.00           C  
+ATOM    144  NZ  LYS A   8      -6.596  -8.795   0.413  1.00  0.00           N  
+ATOM    145  H   LYS A   8      -3.180  -3.623   0.110  1.00  0.00           H  
+ATOM    146  HA  LYS A   8      -3.483  -6.388   0.485  1.00  0.00           H  
+ATOM    147  HB2 LYS A   8      -4.667  -4.665  -1.133  1.00  0.00           H  
+ATOM    148  HB3 LYS A   8      -3.469  -5.209  -2.302  1.00  0.00           H  
+ATOM    149  HG2 LYS A   8      -5.179  -6.640  -2.800  1.00  0.00           H  
+ATOM    150  HG3 LYS A   8      -4.383  -7.626  -1.648  1.00  0.00           H  
+ATOM    151  HD2 LYS A   8      -6.571  -5.716  -0.797  1.00  0.00           H  
+ATOM    152  HD3 LYS A   8      -6.998  -7.246  -1.531  1.00  0.00           H  
+ATOM    153  HE2 LYS A   8      -5.079  -7.389   0.729  1.00  0.00           H  
+ATOM    154  HE3 LYS A   8      -6.699  -6.816   1.151  1.00  0.00           H  
+ATOM    155  HZ1 LYS A   8      -7.551  -8.825   0.081  1.00  0.00           H  
+ATOM    156  HZ2 LYS A   8      -6.018  -9.355  -0.202  1.00  0.00           H  
+ATOM    157  HZ3 LYS A   8      -6.565  -9.193   1.343  1.00  0.00           H  
+ATOM    158  N   ASP A   9      -0.838  -5.715  -1.323  1.00  0.00           N  
+ATOM    159  CA  ASP A   9       0.450  -6.224  -1.807  1.00  0.00           C  
+ATOM    160  C   ASP A   9       1.375  -6.712  -0.666  1.00  0.00           C  
+ATOM    161  O   ASP A   9       2.268  -7.521  -0.902  1.00  0.00           O  
+ATOM    162  CB  ASP A   9       1.122  -5.114  -2.638  1.00  0.00           C  
+ATOM    163  CG  ASP A   9       1.749  -5.645  -3.931  1.00  0.00           C  
+ATOM    164  OD1 ASP A   9       2.908  -6.107  -3.879  1.00  0.00           O  
+ATOM    165  OD2 ASP A   9       1.053  -5.563  -4.967  1.00  0.00           O  
+ATOM    166  H   ASP A   9      -1.027  -4.724  -1.433  1.00  0.00           H  
+ATOM    167  HA  ASP A   9       0.258  -7.078  -2.459  1.00  0.00           H  
+ATOM    168  HB2 ASP A   9       0.383  -4.379  -2.891  1.00  0.00           H  
+ATOM    169  HB3 ASP A   9       1.874  -4.603  -2.038  1.00  0.00           H  
+ATOM    170  N   GLY A  10       1.131  -6.267   0.578  1.00  0.00           N  
+ATOM    171  CA  GLY A  10       1.947  -6.573   1.759  1.00  0.00           C  
+ATOM    172  C   GLY A  10       2.471  -5.343   2.517  1.00  0.00           C  
+ATOM    173  O   GLY A  10       3.312  -5.492   3.405  1.00  0.00           O  
+ATOM    174  H   GLY A  10       0.292  -5.717   0.714  1.00  0.00           H  
+ATOM    175  HA2 GLY A  10       1.343  -7.159   2.453  1.00  0.00           H  
+ATOM    176  HA3 GLY A  10       2.809  -7.177   1.472  1.00  0.00           H  
+ATOM    177  N   GLY A  11       2.017  -4.128   2.178  1.00  0.00           N  
+ATOM    178  CA  GLY A  11       2.486  -2.885   2.787  1.00  0.00           C  
+ATOM    179  C   GLY A  11       4.008  -2.719   2.637  1.00  0.00           C  
+ATOM    180  O   GLY A  11       4.503  -2.800   1.506  1.00  0.00           O  
+ATOM    181  H   GLY A  11       1.396  -4.039   1.378  1.00  0.00           H  
+ATOM    182  HA2 GLY A  11       2.001  -2.048   2.288  1.00  0.00           H  
+ATOM    183  HA3 GLY A  11       2.186  -2.879   3.832  1.00  0.00           H  
+ATOM    184  N   PRO A  12       4.780  -2.519   3.728  1.00  0.00           N  
+ATOM    185  CA  PRO A  12       6.239  -2.387   3.665  1.00  0.00           C  
+ATOM    186  C   PRO A  12       6.950  -3.575   3.000  1.00  0.00           C  
+ATOM    187  O   PRO A  12       7.979  -3.391   2.354  1.00  0.00           O  
+ATOM    188  CB  PRO A  12       6.713  -2.228   5.117  1.00  0.00           C  
+ATOM    189  CG  PRO A  12       5.470  -1.751   5.866  1.00  0.00           C  
+ATOM    190  CD  PRO A  12       4.331  -2.431   5.110  1.00  0.00           C  
+ATOM    191  HA  PRO A  12       6.480  -1.479   3.109  1.00  0.00           H  
+ATOM    192  HB2 PRO A  12       7.058  -3.165   5.510  1.00  0.00           H  
+ATOM    193  HB3 PRO A  12       7.527  -1.506   5.194  1.00  0.00           H  
+ATOM    194  HG2 PRO A  12       5.494  -2.065   6.892  1.00  0.00           H  
+ATOM    195  HG3 PRO A  12       5.378  -0.669   5.771  1.00  0.00           H  
+ATOM    196  HD2 PRO A  12       4.149  -3.411   5.508  1.00  0.00           H  
+ATOM    197  HD3 PRO A  12       3.421  -1.842   5.212  1.00  0.00           H  
+ATOM    198  N   SER A  13       6.391  -4.788   3.108  1.00  0.00           N  
+ATOM    199  CA  SER A  13       6.963  -6.030   2.565  1.00  0.00           C  
+ATOM    200  C   SER A  13       6.817  -6.172   1.040  1.00  0.00           C  
+ATOM    201  O   SER A  13       7.075  -7.245   0.502  1.00  0.00           O  
+ATOM    202  CB  SER A  13       6.348  -7.235   3.292  1.00  0.00           C  
+ATOM    203  OG  SER A  13       6.588  -7.135   4.685  1.00  0.00           O  
+ATOM    204  H   SER A  13       5.511  -4.881   3.605  1.00  0.00           H  
+ATOM    205  HA  SER A  13       8.033  -6.031   2.772  1.00  0.00           H  
+ATOM    206  HB2 SER A  13       5.290  -7.255   3.114  1.00  0.00           H  
+ATOM    207  HB3 SER A  13       6.798  -8.157   2.922  1.00  0.00           H  
+ATOM    208  HG  SER A  13       7.535  -7.126   4.838  1.00  0.00           H  
+ATOM    209  N   SER A  14       6.433  -5.095   0.342  1.00  0.00           N  
+ATOM    210  CA  SER A  14       6.094  -5.070  -1.091  1.00  0.00           C  
+ATOM    211  C   SER A  14       7.131  -4.326  -1.948  1.00  0.00           C  
+ATOM    212  O   SER A  14       6.912  -4.123  -3.139  1.00  0.00           O  
+ATOM    213  CB  SER A  14       4.713  -4.430  -1.320  1.00  0.00           C  
+ATOM    214  OG  SER A  14       3.852  -4.557  -0.209  1.00  0.00           O  
+ATOM    215  H   SER A  14       6.248  -4.262   0.883  1.00  0.00           H  
+ATOM    216  HA  SER A  14       6.036  -6.095  -1.458  1.00  0.00           H  
+ATOM    217  HB2 SER A  14       4.851  -3.386  -1.528  1.00  0.00           H  
+ATOM    218  HB3 SER A  14       4.256  -4.900  -2.188  1.00  0.00           H  
+ATOM    219  HG  SER A  14       4.090  -3.859   0.448  1.00  0.00           H  
+ATOM    220  N   GLY A  15       8.234  -3.851  -1.350  1.00  0.00           N  
+ATOM    221  CA  GLY A  15       9.242  -3.043  -2.046  1.00  0.00           C  
+ATOM    222  C   GLY A  15       8.765  -1.634  -2.430  1.00  0.00           C  
+ATOM    223  O   GLY A  15       9.339  -1.029  -3.333  1.00  0.00           O  
+ATOM    224  H   GLY A  15       8.368  -4.078  -0.374  1.00  0.00           H  
+ATOM    225  HA2 GLY A  15      10.125  -2.943  -1.415  1.00  0.00           H  
+ATOM    226  HA3 GLY A  15       9.540  -3.557  -2.962  1.00  0.00           H  
+ATOM    227  N   ARG A  16       7.712  -1.116  -1.776  1.00  0.00           N  
+ATOM    228  CA  ARG A  16       7.012   0.119  -2.159  1.00  0.00           C  
+ATOM    229  C   ARG A  16       6.744   1.004  -0.927  1.00  0.00           C  
+ATOM    230  O   ARG A  16       6.192   0.494   0.050  1.00  0.00           O  
+ATOM    231  CB  ARG A  16       5.715  -0.274  -2.903  1.00  0.00           C  
+ATOM    232  CG  ARG A  16       5.325   0.703  -4.024  1.00  0.00           C  
+ATOM    233  CD  ARG A  16       4.678   2.015  -3.540  1.00  0.00           C  
+ATOM    234  NE  ARG A  16       3.237   2.087  -3.842  1.00  0.00           N  
+ATOM    235  CZ  ARG A  16       2.680   2.273  -5.035  1.00  0.00           C  
+ATOM    236  NH1 ARG A  16       3.403   2.443  -6.118  1.00  0.00           N  
+ATOM    237  NH2 ARG A  16       1.375   2.289  -5.163  1.00  0.00           N  
+ATOM    238  H   ARG A  16       7.321  -1.668  -1.025  1.00  0.00           H  
+ATOM    239  HA  ARG A  16       7.663   0.650  -2.853  1.00  0.00           H  
+ATOM    240  HB2 ARG A  16       5.853  -1.247  -3.334  1.00  0.00           H  
+ATOM    241  HB3 ARG A  16       4.890  -0.391  -2.200  1.00  0.00           H  
+ATOM    242  HG2 ARG A  16       6.212   0.951  -4.574  1.00  0.00           H  
+ATOM    243  HG3 ARG A  16       4.637   0.186  -4.695  1.00  0.00           H  
+ATOM    244  HD2 ARG A  16       4.810   2.091  -2.478  1.00  0.00           H  
+ATOM    245  HD3 ARG A  16       5.186   2.860  -4.006  1.00  0.00           H  
+ATOM    246  HE  ARG A  16       2.615   2.042  -3.054  1.00  0.00           H  
+ATOM    247 HH11 ARG A  16       4.402   2.431  -6.023  1.00  0.00           H  
+ATOM    248 HH12 ARG A  16       2.980   2.582  -7.018  1.00  0.00           H  
+ATOM    249 HH21 ARG A  16       0.783   2.132  -4.366  1.00  0.00           H  
+ATOM    250 HH22 ARG A  16       0.966   2.417  -6.070  1.00  0.00           H  
+ATOM    251  N   PRO A  17       7.089   2.310  -0.946  1.00  0.00           N  
+ATOM    252  CA  PRO A  17       6.885   3.210   0.196  1.00  0.00           C  
+ATOM    253  C   PRO A  17       5.393   3.477   0.503  1.00  0.00           C  
+ATOM    254  O   PRO A  17       4.546   3.303  -0.377  1.00  0.00           O  
+ATOM    255  CB  PRO A  17       7.623   4.504  -0.182  1.00  0.00           C  
+ATOM    256  CG  PRO A  17       7.588   4.505  -1.707  1.00  0.00           C  
+ATOM    257  CD  PRO A  17       7.737   3.023  -2.038  1.00  0.00           C  
+ATOM    258  HA  PRO A  17       7.356   2.774   1.077  1.00  0.00           H  
+ATOM    259  HB2 PRO A  17       7.117   5.363   0.213  1.00  0.00           H  
+ATOM    260  HB3 PRO A  17       8.658   4.442   0.155  1.00  0.00           H  
+ATOM    261  HG2 PRO A  17       6.657   4.893  -2.074  1.00  0.00           H  
+ATOM    262  HG3 PRO A  17       8.394   5.099  -2.134  1.00  0.00           H  
+ATOM    263  HD2 PRO A  17       7.256   2.797  -2.970  1.00  0.00           H  
+ATOM    264  HD3 PRO A  17       8.794   2.757  -2.066  1.00  0.00           H  
+ATOM    265  N   PRO A  18       5.059   3.929   1.730  1.00  0.00           N  
+ATOM    266  CA  PRO A  18       3.682   4.205   2.144  1.00  0.00           C  
+ATOM    267  C   PRO A  18       3.095   5.411   1.383  1.00  0.00           C  
+ATOM    268  O   PRO A  18       3.661   6.502   1.452  1.00  0.00           O  
+ATOM    269  CB  PRO A  18       3.748   4.459   3.655  1.00  0.00           C  
+ATOM    270  CG  PRO A  18       5.175   4.956   3.878  1.00  0.00           C  
+ATOM    271  CD  PRO A  18       5.977   4.185   2.832  1.00  0.00           C  
+ATOM    272  HA  PRO A  18       3.080   3.317   1.975  1.00  0.00           H  
+ATOM    273  HB2 PRO A  18       3.033   5.203   3.949  1.00  0.00           H  
+ATOM    274  HB3 PRO A  18       3.609   3.517   4.186  1.00  0.00           H  
+ATOM    275  HG2 PRO A  18       5.245   6.014   3.714  1.00  0.00           H  
+ATOM    276  HG3 PRO A  18       5.524   4.748   4.890  1.00  0.00           H  
+ATOM    277  HD2 PRO A  18       6.810   4.771   2.495  1.00  0.00           H  
+ATOM    278  HD3 PRO A  18       6.310   3.236   3.253  1.00  0.00           H  
+ATOM    279  N   PRO A  19       1.966   5.253   0.661  1.00  0.00           N  
+ATOM    280  CA  PRO A  19       1.331   6.356  -0.052  1.00  0.00           C  
+ATOM    281  C   PRO A  19       0.578   7.268   0.928  1.00  0.00           C  
+ATOM    282  O   PRO A  19      -0.202   6.793   1.754  1.00  0.00           O  
+ATOM    283  CB  PRO A  19       0.397   5.681  -1.061  1.00  0.00           C  
+ATOM    284  CG  PRO A  19      -0.022   4.391  -0.357  1.00  0.00           C  
+ATOM    285  CD  PRO A  19       1.197   4.027   0.492  1.00  0.00           C  
+ATOM    286  HA  PRO A  19       2.080   6.941  -0.589  1.00  0.00           H  
+ATOM    287  HB2 PRO A  19      -0.455   6.299  -1.267  1.00  0.00           H  
+ATOM    288  HB3 PRO A  19       0.960   5.433  -1.961  1.00  0.00           H  
+ATOM    289  HG2 PRO A  19      -0.883   4.555   0.261  1.00  0.00           H  
+ATOM    290  HG3 PRO A  19      -0.265   3.606  -1.072  1.00  0.00           H  
+ATOM    291  HD2 PRO A  19       0.884   3.651   1.447  1.00  0.00           H  
+ATOM    292  HD3 PRO A  19       1.805   3.288  -0.030  1.00  0.00           H  
+ATOM    293  N   SER A  20       0.794   8.581   0.820  1.00  0.00           N  
+ATOM    294  CA  SER A  20       0.068   9.633   1.546  1.00  0.00           C  
+ATOM    295  C   SER A  20      -0.019  10.895   0.692  1.00  0.00           C  
+ATOM    296  O   SER A  20       0.894  11.061  -0.156  1.00  0.00           O  
+ATOM    297  CB  SER A  20       0.690   9.909   2.920  1.00  0.00           C  
+ATOM    298  OG  SER A  20       2.087  10.037   2.813  1.00  0.00           O  
+ATOM    299  OXT SER A  20      -1.022  11.612   0.858  1.00  0.00           O  
+ATOM    300  H   SER A  20       1.377   8.948   0.073  1.00  0.00           H  
+ATOM    301  HA  SER A  20      -0.962   9.316   1.705  1.00  0.00           H  
+ATOM    302  HB2 SER A  20       0.282  10.819   3.316  1.00  0.00           H  
+ATOM    303  HB3 SER A  20       0.461   9.076   3.584  1.00  0.00           H  
+ATOM    304  HG  SER A  20       2.347   9.513   2.048  1.00  0.00           H  
+TER     305      SER A  20                                                      
+ENDMDL                                                                          
+MASTER      109    0    0    2    0    0    0    611552   38    0    2          
+END                                                                             

diff --git a/source/ga/input-templates/1LE1.pdb b/source/ga/input-templates/1LE1.pdb
new file mode 100644 (file)
index 0000000..9a4e460
--- /dev/null
+++ b/source/ga/input-templates/1LE1.pdb
@@ -0,0 +1,4612 @@
+HEADER    DE NOVO PROTEIN                         09-APR-02   1LE1              
+TITLE     NMR STRUCTURE OF TRYPTOPHAN ZIPPER 2: A STABLE, MONOMERIC             
+TITLE    2 BETA-HAIRPIN WITH A TYPE I' TURN                                     
+COMPND    MOL_ID: 1;                                                            
+COMPND   2 MOLECULE: TRYPTOPHAN ZIPPER 2;                                       
+COMPND   3 CHAIN: A;                                                            
+COMPND   4 ENGINEERED: YES                                                      
+SOURCE    MOL_ID: 1;                                                            
+SOURCE   2 SYNTHETIC: YES;                                                      
+SOURCE   3 OTHER_DETAILS: THIS SEQUENCE WAS DESIGNED BASED ON                   
+SOURCE   4 EXPERIMENTAL DATA OBTAINED FROM A MODEL SYSTEM. THE                  
+SOURCE   5 PEPTIDE WAS CHEMICALLY SYNTHESIZED AND DOES NOT APPEAR TO            
+SOURCE   6 OCCUR IN NATURE.                                                     
+KEYWDS    BETA-HAIRPIN, TYPE I' TURN                                            
+EXPDTA    NMR, 20 STRUCTURES                                                    
+AUTHOR    A.G.COCHRAN,N.J.SKELTON,M.A.STAROVASNIK                               
+REVDAT   2   20-NOV-02 1LE1    1       REMARK                                   
+REVDAT   1   24-APR-02 1LE1    0                                                
+SPRSDE     24-APR-02 1LE1      1HRX                                             
+JRNL        AUTH   A.G.COCHRAN,N.J.SKELTON,M.A.STAROVASNIK                      
+JRNL        TITL   TRYPTOPHAN ZIPPERS: STABLE, MONOMERIC BETA                   
+JRNL        TITL 2 -HAIRPINS.                                                   
+JRNL        REF    PROC.NATL.ACAD.SCI.USA        V.  98  5578 2001              
+JRNL        REFN   ASTM PNASA6  US ISSN 0027-8424                               
+REMARK   1                                                                      
+REMARK   1 REFERENCE 1                                                          
+REMARK   1  AUTH   N.J.SKELTON,A.G.COCHRAN,M.A.STAROVASNIK                      
+REMARK   1  TITL   CHEMICAL-SHIFT-BASED METHODS FOR STRUCTURE                   
+REMARK   1  TITL 2 VALIDATION AND REFINEMENT: APPLICATION TO                    
+REMARK   1  TITL 3 TRYPTOPHAN ZIPPER BETA-HAIRPIN PEPTIDES                      
+REMARK   1  REF    TO BE PUBLISHED                                              
+REMARK   1  REFN                                                                
+REMARK   2                                                                      
+REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
+REMARK   3                                                                      
+REMARK   3 REFINEMENT.                                                          
+REMARK   3   PROGRAM     : AMBER 6.0                                            
+REMARK   3   AUTHORS     : CASE AND KOLLMAN                                     
+REMARK   3                                                                      
+REMARK   3  OTHER REFINEMENT REMARKS: STRUCTURES ARE BASED ON A TOTAL OF        
+REMARK   3  80 (INCLUDING 26 INTRA-RESIDUE, 15 SEQUENTIAL, 6 MEDIUM-RANGE,      
+REMARK   3  AND 33 LONG-RANGE) NOE-DERIVED DISTANCE RESTRAINTS, 15              
+REMARK   3  DIHEDRAL ANGLE RESTRAINTS, AND 1H CHEMICAL SHIFT RESTRAINTS         
+REMARK   3  FOR 39 CARBON-BOUND 1H RESONANCES; (CHEMICAL SHIFT RESTRAINTS       
+REMARK   3  WERE NOT IMPOSED FOR THE TERMINAL RESIDUES, OR FOR SIDE CHAINS      
+REMARK   3  EXHIBITING EVIDENCE OF ROTATIONAL AVERAGING). THE ENSEMBLE          
+REMARK   3  AGREES WELL WITH THE EXPERIMENTAL RESTRAINTS WITH NO DISTANCE       
+REMARK   3  OR DIHEDRAL ANGLE VIOLATIONS GREATER THAN 0.10 ANGSTROM OR 5        
+REMARK   3  DEG, RESPECTIVELY, AND AN AVERAGE RMSD OF ONLY 0.087 PPM            
+REMARK   3  BETWEEN OBSERVED AND CALCULATED CHEMICAL SHIFTS.                    
+REMARK   4                                                                      
+REMARK   4 1LE1 COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006                         
+REMARK   4                                                                      
+REMARK   4 THIS IS THE REMEDIATED VERSION OF THIS PDB ENTRY.                    
+REMARK   4 REMEDIATED DATA FILE REVISION 3.100 (2007-03-17)                     
+REMARK 100                                                                      
+REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ .                              
+REMARK 100 THE RCSB ID CODE IS RCSB015868.                                      
+REMARK 210                                                                      
+REMARK 210 EXPERIMENTAL DETAILS                                                 
+REMARK 210  EXPERIMENT TYPE                : NMR                                
+REMARK 210  TEMPERATURE           (KELVIN) : 288                                
+REMARK 210  PH                             : 5.5                                
+REMARK 210  IONIC STRENGTH                 : 0                                  
+REMARK 210  PRESSURE                       : AMBIENT                            
+REMARK 210  SAMPLE CONTENTS                : 3MM TRPZIP2                        
+REMARK 210                                                                      
+REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY, DQF-COSY, 2D TOCSY,      
+REMARK 210                                   2D ROESY, 2D COSY-35               
+REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
+REMARK 210  SPECTROMETER MODEL             : DRX                                
+REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
+REMARK 210                                                                      
+REMARK 210  STRUCTURE DETERMINATION.                                            
+REMARK 210   SOFTWARE USED                 : XWINNMR 2.5, FELIX 98.0, DGII      
+REMARK 210                                   98.0                               
+REMARK 210   METHOD USED                   : HYBRID DISTANCE GEOMETRY/          
+REMARK 210                                   SIMULATED ANNEALING USING THE      
+REMARK 210                                   PROGRAM DGII, FOLLOWED BY          
+REMARK 210                                   MOLECULAR DYNAMICS USING THE       
+REMARK 210                                   PROGRAM AMBER, IN CONJUNCTION      
+REMARK 210                                   NOT ONLY WITH DISTANCE AND         
+REMARK 210                                   DIHEDRAL ANGLE RESTRAINTS, BUT     
+REMARK 210                                   ALSO 1H CHEMICAL SHIFT-BASED       
+REMARK 210                                   RESTRAINTS.                        
+REMARK 210                                                                      
+REMARK 210 CONFORMERS, NUMBER CALCULATED   : 76                                 
+REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
+REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LEAST          
+REMARK 210                                   RESTRAINT VIOLATIONS               
+REMARK 210                                                                      
+REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
+REMARK 210                                                                      
+REMARK 210 REMARK: THE STRUCTURE OF TRPZIP2 WAS ORIGINALLY DETERMINED           
+REMARK 210  USING STANDARD 2D HOMONUCLEAR TECHNIQUES (COCHRAN ET AL.,           
+REMARK 210  2001, PROC. NATL. ACAD. SCI. USA, 98, 5578-5583). DISTANCE AND      
+REMARK 210  DIHEDRAL ANGLE RESTRAINTS WERE DERIVED FROM ANALYSIS OF NOESY,      
+REMARK 210  ROESY, DQF-COSY, AND COSY-35 DATA. CHI-1 ROTAMERS AND               
+REMARK 210  STEREOSPECIFIC ASSIGNMENTS FOR BETA-METHYLENE GROUPS WERE           
+REMARK 210  BASED ON COMBINED ANALYSIS OF 3JHAHB AND LOCAL ROES,                
+REMARK 210  SUGGESTING THAT ALL FOUR TRP RESIDUES ADOPT A CHI1 OF -60 DEG.      
+REMARK 210  QUANTITATIVE ANALYSIS OF THE 1H CHEMICAL SHIFTS, HOWEVER,           
+REMARK 210  REVEALED THAT THE FREQUENCIES OF THE HB AND HE3 RESONANCES OF       
+REMARK 210  TRP4 AND TRP11 WERE INCONSISTENT WITH A -60 DEG CHI1 VALUE,         
+REMARK 210  AND INDICATED THAT THE SIDE CHAINS FOR THESE TRYPTOPHANS            
+REMARK 210  ACTUALLY RESIDE PRIMARILY IN THE 180 DEG CHI1 ROTAMER (SKELTON      
+REMARK 210  ET AL., MANUSCRIPT IN PREPARATION). THE CURRENT COORDINATES         
+REMARK 210  RESULT FROM REFINEMENT WITH THE SANDER MODULE OF AMBER (V6.0),      
+REMARK 210  AND INCLUDED NOT ONLY NOE-DERIVED DISTANCE RESTRAINTS AND           
+REMARK 210  DIHEDRAL ANGLE RESTRAINTS, BUT ALSO 1H CHEMICAL SHIFT-BASED         
+REMARK 210  RESTRAINTS. THUS, THE RESULTING UPDATED COORDINATES DIFFER          
+REMARK 210  FROM THE PREVIOUS ONES IN THE SIDE CHAIN ORIENTATIONS OF TRP4       
+REMARK 210  AND TRP11. HOWEVER, THE REST OF THE STRUCTURE IS SIMILAR WITH       
+REMARK 210  A BACKBONE RMSD BETWEEN THE AVERAGE COORDINATES OF THE TWO          
+REMARK 210  ENSEMBLES OF 0.69 ANGSTROM(RES.2-11). THE TWO STRANDS ARE           
+REMARK 210  HIGHLY TWISTED, AS DESCRIBED PREVIOUSLY, HOWEVER THERE IS A         
+REMARK 210  SLIGHT DIFFERENCE IN THE RELATIVE POSITION OF THE TURN WITH         
+REMARK 210  RESPECT TO THE STRANDS. THE KEY DIFFERENCE, HOWEVER, IS THAT        
+REMARK 210  EACH PAIR OF CROSS-STRAND TRYPTOPHAN RINGS NOW SHOWS EDGE-TO-       
+REMARK 210  FACE PACKING AGAINST ONE ANOTHER.                                   
+REMARK 215                                                                      
+REMARK 215 NMR STUDY                                                            
+REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
+REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
+REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
+REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
+REMARK 900                                                                      
+REMARK 900 RELATED ENTRIES                                                      
+REMARK 900 RELATED ID: 1LE0   RELATED DB: PDB                                   
+REMARK 900 1LE0 CONTAINS TRYPTOPHAN ZIPPER 1                                    
+REMARK 900 RELATED ID: 1LE3   RELATED DB: PDB                                   
+REMARK 900 1LE3 CONTAINS TRYPTOPHAN ZIPPER 4                                    
+SEQRES   1 A   12  SER TRP THR TRP GLU ASN GLY LYS TRP THR TRP LYS              
+HET    NH2  A  13       3                                                       
+HETNAM     NH2 AMINO GROUP                                                      
+FORMUL   2  NH2    H2 N                                                         
+SHEET    1   A 2 TRP A   2  GLU A   5  0                                        
+SHEET    2   A 2 LYS A   8  TRP A  11 -1  O  THR A  10   N  THR A   3           
+LINK         C   LYS A  12                 N   NH2 A  13                        
+CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
+ORIGX1      1.000000  0.000000  0.000000        0.00000                         
+ORIGX2      0.000000  1.000000  0.000000        0.00000                         
+ORIGX3      0.000000  0.000000  1.000000        0.00000                         
+SCALE1      1.000000  0.000000  0.000000        0.00000                         
+SCALE2      0.000000  1.000000  0.000000        0.00000                         
+SCALE3      0.000000  0.000000  1.000000        0.00000                         
+MODEL        1                                                                  
+ATOM      1  N   SER A   1      -2.559   9.064   0.084  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.245   8.118   0.982  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.725   6.697   0.804  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.635   6.180  -0.308  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.757   8.129   0.767  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.352   7.344   1.778  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.047   8.429   2.008  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.133   9.150   0.836  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.998   7.717  -0.215  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -6.291   7.248   1.593  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.882  10.004   0.269  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.761   8.824  -0.877  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -1.562   9.017   0.240  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.371   6.035   1.905  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.055   4.608   1.891  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.337   3.758   1.821  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.252   3.931   2.622  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.194   4.267   3.114  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.197   4.832   3.076  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.672   5.854   3.826  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.330   4.366   2.280  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       2.018   6.036   3.562  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.492   5.094   2.669  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.495   3.358   1.307  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.768   4.797   2.159  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.769   3.041   0.797  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.905   3.751   1.227  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.515   6.481   2.797  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.466   4.390   0.999  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.695   4.583   4.032  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.099   3.183   3.166  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.088   6.419   4.542  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.582   6.754   3.994  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.626   2.811   0.982  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.635   5.351   2.483  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.884   2.242   0.079  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.877   3.489   0.834  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.413   2.838   0.851  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.485   1.827   0.703  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.862   0.430   0.545  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.723   0.300   0.086  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.403   2.197  -0.476  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.975   3.465  -0.238  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -6.572   1.229  -0.680  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.644   2.788   0.185  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.108   1.793   1.602  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.812   2.237  -1.391  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -5.743   3.735   0.657  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -7.275   1.661  -1.392  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.213   0.281  -1.082  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -7.091   1.058   0.264  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.554  -0.599   1.052  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.077  -1.984   1.068  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.328  -2.716  -0.248  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.463  -2.831  -0.716  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.744  -2.756   2.214  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.431  -4.227   2.295  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.181  -5.229   1.780  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.312  -4.881   2.961  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.628  -6.450   2.123  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.489  -6.292   2.884  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.176  -4.415   3.650  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.612  -7.193   3.506  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.275  -5.303   4.261  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.502  -6.689   4.209  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.470  -0.430   1.438  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.000  -1.963   1.222  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.447  -2.298   3.158  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.827  -2.650   2.125  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.098  -5.083   1.221  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.056  -7.336   1.896  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.013  -3.352   3.697  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.783  -8.258   3.448  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.408  -4.915   4.776  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.808  -7.360   4.698  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.270  -3.336  -0.771  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.331  -4.152  -1.962  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.415  -5.368  -1.752  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.233  -5.215  -1.452  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.966  -3.283  -3.174  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.063  -4.020  -4.514  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.697  -3.073  -5.657  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -1.480  -2.841  -5.839  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -3.635  -2.580  -6.321  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.371  -3.284  -0.290  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.370  -4.452  -2.081  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.664  -2.443  -3.211  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.959  -2.884  -3.050  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.386  -4.874  -4.521  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -4.083  -4.385  -4.654  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.982  -6.575  -1.867  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.345  -7.896  -1.830  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.084  -8.010  -0.944  1.00  0.00           C  
+ATOM     94  O   ASN A   6       0.025  -8.210  -1.438  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.094  -8.350  -3.282  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -3.339  -8.330  -4.165  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -4.454  -8.071  -3.735  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -3.180  -8.596  -5.443  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.940  -6.600  -2.190  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.072  -8.587  -1.403  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -1.344  -7.695  -3.728  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.699  -9.366  -3.269  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -2.284  -8.823  -5.835  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -4.022  -8.532  -5.988  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.264  -7.970   0.384  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.160  -8.111   1.339  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.656  -6.840   1.602  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.564  -6.899   2.431  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.197  -7.857   0.747  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.543  -8.470   2.292  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.535  -8.859   0.962  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.365  -5.710   0.937  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.145  -4.471   1.064  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.266  -3.216   1.125  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.934  -3.239   0.848  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.150  -4.394  -0.110  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.542  -3.884   0.304  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.385  -4.972   0.988  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.706  -4.394   1.504  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       6.664  -5.459   1.847  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.372  -5.725   0.233  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.697  -4.515   2.003  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.269  -5.375  -0.576  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.746  -3.729  -0.878  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       4.070  -3.561  -0.595  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.441  -3.023   0.965  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.840  -5.406   1.825  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.596  -5.757   0.259  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       6.146  -3.760   0.735  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       5.513  -3.789   2.391  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       6.347  -5.949   2.672  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       6.732  -6.111   1.078  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       7.572  -5.055   2.023  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.893  -2.088   1.458  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.313  -0.755   1.333  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.891  -0.114   0.065  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.097  -0.196  -0.163  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.609   0.069   2.600  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.079  -0.404   3.847  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.498  -1.073   4.870  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.467  -0.192   4.246  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.443  -1.315   5.854  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.663  -0.753   5.540  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.561   0.474   3.662  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.886  -0.653   6.225  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.793   0.583   4.333  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.955   0.025   5.613  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.886  -2.132   1.629  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.769  -0.828   1.222  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.686   0.117   2.780  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.273   1.089   2.428  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.537  -1.375   4.900  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.239  -1.812   6.709  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.427   0.937   2.700  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.006  -1.088   7.206  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.612   1.116   3.872  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.902   0.125   6.125  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.046   0.531  -0.748  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.472   1.375  -1.878  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.111   2.787  -1.735  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.171   2.979  -1.125  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.194   0.708  -3.240  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.757   1.509  -4.251  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.276   0.504  -3.601  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.945   0.541  -0.504  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.556   1.498  -1.838  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.687  -0.265  -3.261  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.380   1.228  -5.089  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.745  -0.171  -2.886  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.798   1.459  -3.601  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.350   0.056  -4.594  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.643   3.792  -2.196  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.305   5.209  -2.062  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.622   5.647  -3.206  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.177   5.884  -4.329  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.592   6.054  -1.964  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.401   7.529  -1.750  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.538   8.480  -2.702  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.030   8.244  -0.531  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.312   9.728  -2.152  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.978   9.641  -0.817  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.706   7.853   0.784  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.647  10.599   0.155  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.382   8.801   1.772  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.357  10.171   1.463  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.478   3.551  -2.712  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.252   5.330  -1.135  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.197   5.673  -1.139  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.187   5.915  -2.865  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.807   8.280  -3.731  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.397  10.590  -2.672  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.700   6.801   1.022  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.636  11.651  -0.090  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.145   8.475   2.774  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.115  10.892   2.231  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.927   5.732  -2.914  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -3.002   6.119  -3.835  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.384   7.586  -3.620  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.583   8.050  -2.504  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -4.237   5.217  -3.619  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.022   3.714  -3.888  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -3.661   3.366  -5.343  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -4.848   3.505  -6.302  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -4.396   3.513  -7.704  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.195   5.599  -1.939  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.646   6.011  -4.859  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.570   5.328  -2.585  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -5.045   5.573  -4.260  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -3.231   3.350  -3.234  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -4.936   3.182  -3.623  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -2.842   4.002  -5.679  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -3.318   2.333  -5.383  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -5.530   2.667  -6.154  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.380   4.433  -6.095  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -4.031   2.603  -7.947  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -5.169   3.739  -8.313  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -3.668   4.205  -7.814  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.537   8.337  -4.700  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -3.387   7.953  -5.617  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -3.795   9.301  -4.560  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        2                                                                  
+ATOM      1  N   SER A   1      -2.339   9.400   1.032  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.408   8.399   1.075  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.824   7.007   0.833  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.522   6.657  -0.305  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.470   8.775   0.039  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.586   7.922   0.135  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.863   8.421   2.066  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.799   9.798   0.229  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.045   8.728  -0.966  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -6.272   8.258  -0.451  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.689  10.297   1.335  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -1.987   9.474   0.087  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -1.585   9.108   1.638  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.612   6.208   1.887  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.232   4.794   1.745  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.478   3.902   1.611  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.433   4.072   2.367  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.389   4.336   2.949  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.009   4.879   3.034  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.429   5.885   3.836  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.206   4.399   2.348  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.796   6.055   3.691  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.333   5.127   2.826  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.452   3.401   1.386  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.643   4.844   2.407  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.757   3.127   0.933  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.852   3.836   1.452  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.866   6.529   2.810  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.637   4.671   0.842  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.918   4.572   3.873  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.302   3.248   2.917  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.210   6.459   4.494  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.334   6.764   4.170  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.614   2.845   1.003  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.479   5.394   2.812  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.925   2.369   0.182  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.851   3.610   1.104  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.448   2.926   0.690  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.451   1.850   0.576  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.787   0.470   0.462  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.601   0.364   0.137  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.438   2.121  -0.572  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -6.643   1.459  -0.272  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -4.991   1.613  -1.945  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.636   2.865   0.075  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.040   1.834   1.496  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.628   3.195  -0.635  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -7.180   1.455  -1.068  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -3.978   1.954  -2.154  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -5.017   0.522  -1.969  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -5.662   1.996  -2.715  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.514  -0.582   0.857  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.985  -1.941   0.966  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.037  -2.733  -0.349  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.016  -2.714  -1.096  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.711  -2.665   2.111  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.480  -4.143   2.228  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.261  -5.082   1.648  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.438  -4.876   2.947  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.797  -6.339   1.972  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.701  -6.272   2.804  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.308  -4.517   3.718  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.933  -7.256   3.440  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.496  -5.500   4.317  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.825  -6.863   4.207  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.479  -0.417   1.110  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.928  -1.855   1.207  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.424  -2.198   3.053  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.784  -2.512   1.989  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.133  -4.864   1.042  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.253  -7.191   1.677  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.070  -3.471   3.844  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.194  -8.300   3.344  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.610  -5.208   4.865  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.210  -7.610   4.691  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -2.953  -3.464  -0.607  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -2.667  -4.125  -1.860  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -1.994  -5.489  -1.563  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -0.787  -5.541  -1.341  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -1.805  -3.140  -2.682  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -1.315  -3.641  -4.045  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -0.334  -2.642  -4.666  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5       0.829  -2.622  -4.206  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -0.759  -1.909  -5.586  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.176  -3.427   0.053  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -3.624  -4.258  -2.362  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.396  -2.239  -2.859  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -0.939  -2.844  -2.085  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -0.812  -4.601  -3.929  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.172  -3.773  -4.707  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.783  -6.575  -1.474  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.378  -7.982  -1.261  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.084  -8.205  -0.447  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.108  -8.756  -0.957  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.314  -8.720  -2.612  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -3.636  -8.717  -3.352  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -4.688  -8.964  -2.785  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -3.631  -8.430  -4.637  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.771  -6.420  -1.608  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.170  -8.466  -0.690  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -1.532  -8.275  -3.226  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -2.049  -9.763  -2.428  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -2.785  -8.238  -5.145  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -4.540  -8.449  -5.066  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.067  -7.787   0.823  1.00  0.00           N  
+ATOM    106  CA  GLY A   7       0.080  -7.967   1.717  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.946  -6.719   1.908  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.741  -6.705   2.845  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -1.872  -7.290   1.177  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.273  -8.292   2.693  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.726  -8.762   1.344  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.787  -5.670   1.083  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.484  -4.387   1.263  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.523  -3.189   1.222  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.662  -3.330   0.926  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.675  -4.299   0.280  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.371  -3.771  -1.140  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       2.962  -4.618  -2.282  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       2.056  -5.774  -2.722  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       2.069  -6.901  -1.777  1.00  0.00           N  
+ATOM    121  H   LYS A   8       0.131  -5.745   0.305  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.909  -4.383   2.267  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       3.423  -3.637   0.719  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       3.145  -5.282   0.216  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.298  -3.664  -1.299  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       2.807  -2.774  -1.213  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.089  -3.968  -3.148  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       3.948  -4.997  -2.010  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       1.035  -5.406  -2.838  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       2.402  -6.132  -3.690  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       1.492  -6.679  -0.977  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       1.692  -7.725  -2.227  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.014  -7.085  -1.476  1.00  0.00           H  
+ATOM    134  N   TRP A   9       1.036  -1.997   1.526  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.332  -0.730   1.313  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.945  -0.020   0.100  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.163  -0.034  -0.070  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.416   0.155   2.569  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.239  -0.371   3.815  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.410  -0.997   4.821  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.630  -0.249   4.263  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.479  -1.308   5.829  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.738  -0.818   5.566  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.799   0.336   3.734  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.935  -0.810   6.301  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -4.009   0.350   4.454  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.077  -0.218   5.738  1.00  0.00           C  
+ATOM    148  H   TRP A   9       2.019  -1.947   1.746  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.720  -0.919   1.105  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.467   0.354   2.785  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9      -0.044   1.116   2.350  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.469  -1.222   4.826  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.224  -1.818   6.663  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.738   0.811   2.771  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.979  -1.262   7.281  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.889   0.814   4.030  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.008  -0.195   6.290  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.103   0.624  -0.714  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.493   1.535  -1.803  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.139   2.917  -1.597  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.283   3.049  -1.152  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.133   0.927  -3.168  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.749   1.666  -4.195  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.370   0.917  -3.446  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.896   0.535  -0.525  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.577   1.672  -1.805  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.511  -0.095  -3.208  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.462   1.293  -5.034  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.733   1.938  -3.571  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.575   0.356  -4.354  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.892   0.449  -2.612  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.645   3.962  -1.854  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.242   5.362  -1.831  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.627   5.729  -3.052  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.115   5.876  -4.160  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.528   6.191  -1.770  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.325   7.658  -1.639  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.439   8.567  -2.630  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.997   8.402  -0.436  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.208   9.829  -2.117  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.977   9.790  -0.754  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.723   8.031   0.895  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.746  10.773   0.220  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.504   9.006   1.881  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.526  10.376   1.553  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.599   3.772  -2.123  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.332   5.555  -0.924  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.106   5.866  -0.911  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.159   5.986  -2.634  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.686   8.319  -3.656  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.231  10.668  -2.678  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.690   6.982   1.147  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.741  11.818  -0.052  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.282   8.682   2.884  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.342  11.120   2.317  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.944   5.902  -2.859  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.937   6.234  -3.900  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.288   7.729  -3.840  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -4.442   8.136  -3.766  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -4.141   5.269  -3.789  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.851   4.929  -5.118  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.856   5.955  -5.668  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -5.260   6.990  -6.629  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -6.308   7.904  -7.113  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.266   5.893  -1.891  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.474   6.063  -4.872  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.765   4.318  -3.406  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.864   5.634  -3.058  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.113   4.686  -5.883  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -5.422   4.017  -4.934  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -6.620   5.408  -6.223  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.350   6.466  -4.841  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -4.491   7.568  -6.119  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -4.813   6.481  -7.484  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -6.967   7.391  -7.682  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -6.794   8.301  -6.320  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -5.895   8.645  -7.659  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.267   8.575  -3.849  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.328   8.205  -3.883  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.455   9.564  -3.819  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        3                                                                  
+ATOM      1  N   SER A   1      -3.796   9.020  -0.193  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.119   8.485   1.007  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.615   7.046   0.776  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.309   6.673  -0.352  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.041   8.628   2.230  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.201   9.999   2.525  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.231   9.096   1.185  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.011   8.178   2.017  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -3.599   8.141   3.098  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -4.701  10.091   3.341  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -3.300   8.729  -1.024  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -3.812  10.029  -0.141  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -4.744   8.675  -0.226  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.436   6.250   1.832  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.073   4.834   1.735  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.319   3.953   1.623  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.294   4.189   2.325  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.248   4.465   2.982  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.133   5.037   3.074  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.534   6.040   3.889  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.339   4.559   2.409  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.894   6.243   3.738  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.447   5.323   2.873  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.612   3.508   1.508  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.763   5.073   2.447  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.922   3.241   1.071  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.998   4.028   1.537  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.662   6.584   2.753  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.508   4.707   0.815  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.811   4.773   3.859  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.157   3.385   3.049  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.108   6.608   4.542  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.399   6.985   4.193  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.794   2.896   1.174  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.580   5.674   2.812  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.115   2.428   0.388  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       5.003   3.819   1.199  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.257   2.896   0.795  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.321   1.882   0.683  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.754   0.450   0.577  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.602   0.262   0.156  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.281   2.243  -0.473  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -6.553   1.728  -0.159  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -4.909   1.740  -1.870  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.431   2.765   0.208  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -4.917   1.910   1.600  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.358   3.332  -0.513  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -6.754   1.036  -0.792  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -3.924   2.116  -2.150  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -4.908   0.651  -1.899  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -5.644   2.111  -2.584  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.484  -0.545   1.096  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.045  -1.942   1.193  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.261  -2.731  -0.115  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.386  -2.883  -0.580  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.729  -2.613   2.397  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.478  -4.089   2.568  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.289  -5.075   2.120  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.392  -4.762   3.285  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.767  -6.303   2.475  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.617  -6.168   3.221  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.258  -4.326   4.003  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.777  -7.094   3.859  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.409  -5.246   4.639  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.671  -6.623   4.580  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.406  -0.318   1.448  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.976  -1.939   1.384  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.384  -2.110   3.305  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.808  -2.460   2.328  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.204  -4.907   1.572  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.206  -7.182   2.251  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.056  -3.263   4.069  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.982  -8.152   3.800  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.557  -4.884   5.199  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.014  -7.318   5.084  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.160  -3.211  -0.700  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.091  -3.885  -1.995  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.285  -5.192  -1.881  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.160  -5.179  -1.396  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.438  -2.923  -3.010  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.216  -3.476  -4.430  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -3.487  -3.541  -5.284  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -4.499  -4.081  -4.789  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -3.418  -3.063  -6.438  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.286  -3.113  -0.199  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.107  -4.113  -2.322  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.039  -2.015  -3.082  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.460  -2.637  -2.618  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -1.502  -2.823  -4.933  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -1.764  -4.466  -4.387  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.842  -6.315  -2.354  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.166  -7.607  -2.564  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.207  -8.085  -1.438  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.172  -8.692  -1.727  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.499  -7.554  -3.957  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.451  -8.907  -4.646  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.280  -9.225  -5.480  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.495  -9.744  -4.313  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.772  -6.227  -2.743  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.954  -8.361  -2.617  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.058  -6.889  -4.611  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.491  -7.153  -3.866  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6       0.093  -9.520  -3.515  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -0.490 -10.628  -4.789  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.538  -7.832  -0.164  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.729  -8.204   1.009  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.112  -7.069   1.625  1.00  0.00           C  
+ATOM    108  O   GLY A   7       0.763  -7.291   2.654  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.396  -7.330  -0.002  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.377  -8.605   1.787  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7      -0.028  -8.993   0.734  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.087  -5.850   1.055  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.918  -4.726   1.489  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.148  -3.401   1.473  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -1.024  -3.353   1.086  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.196  -4.691   0.632  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       1.957  -4.540  -0.886  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.145  -3.881  -1.606  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.491  -4.588  -1.383  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       5.576  -3.608  -1.192  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.484  -5.716   0.215  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.222  -4.943   2.506  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.826  -3.871   0.979  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       2.750  -5.618   0.793  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.757  -5.520  -1.327  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.091  -3.899  -1.059  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       2.942  -3.859  -2.679  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       3.211  -2.849  -1.259  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.437  -5.226  -0.500  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.713  -5.210  -2.251  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       5.466  -3.165  -0.289  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       6.471  -4.077  -1.232  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       5.525  -2.905  -1.917  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.797  -2.292   1.839  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.262  -0.937   1.641  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.954  -0.299   0.438  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.167  -0.453   0.254  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.422  -0.040   2.878  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.321  -0.463   4.111  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.203  -1.186   5.122  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.656  -0.060   4.556  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.710  -1.274   6.153  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.852  -0.553   5.878  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.699   0.715   4.003  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.011  -0.284   6.623  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.868   0.993   4.739  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.030   0.488   6.039  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.778  -2.372   2.059  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.803  -0.993   1.413  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.481   0.093   3.121  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.050   0.952   2.609  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.199  -1.615   5.122  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.526  -1.747   7.030  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.566   1.143   3.021  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.121  -0.672   7.624  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.652   1.588   4.295  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.930   0.705   6.597  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.203   0.498  -0.336  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.667   1.269  -1.499  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.077   2.686  -1.421  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.065   2.874  -0.995  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.339   0.485  -2.782  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       1.147   0.952  -3.830  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.120   0.526  -3.233  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.801   0.529  -0.136  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.753   1.370  -1.464  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.600  -0.559  -2.603  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.673   1.643  -4.297  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.769   0.171  -2.429  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.413   1.541  -3.509  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.249  -0.131  -4.096  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.899   3.707  -1.698  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.458   5.111  -1.742  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.463   5.368  -2.950  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.465   4.599  -3.914  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.697   6.025  -1.803  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.456   7.511  -1.778  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.446   8.336  -2.851  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.205   8.385  -0.634  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.187   9.633  -2.444  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.050   9.726  -1.079  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.117   8.174   0.757  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.815  10.793  -0.197  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.898   9.232   1.659  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.754  10.540   1.183  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.851   3.508  -1.950  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.091   5.344  -0.830  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.340   5.790  -0.952  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.261   5.794  -2.709  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.605   8.017  -3.872  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.064  10.404  -3.081  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.248   7.169   1.125  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.695  11.794  -0.580  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.858   9.004   2.711  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.601  11.335   1.885  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.225   6.468  -2.910  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.089   6.954  -3.990  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -1.808   8.421  -4.321  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -1.682   9.268  -3.445  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.563   6.752  -3.604  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.987   5.288  -3.815  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.507   5.057  -3.788  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.347   5.957  -4.710  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -5.805   6.062  -6.078  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.233   6.992  -2.040  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.883   6.373  -4.890  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.735   7.041  -2.564  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.170   7.400  -4.236  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -3.610   4.944  -4.779  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.527   4.669  -3.041  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.688   4.021  -4.079  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.866   5.184  -2.767  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.353   5.543  -4.764  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -6.408   6.956  -4.280  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -6.537   6.357  -6.708  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -5.062   6.746  -6.090  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -5.443   5.167  -6.372  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -1.731   8.734  -5.608  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.868   8.029  -6.315  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -1.527   9.689  -5.846  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        4                                                                  
+ATOM      1  N   SER A   1      -3.016   9.390   0.325  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.164   8.377   1.384  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.601   7.019   0.970  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.412   6.741  -0.217  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.635   8.203   1.757  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.709   7.542   3.002  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.623   8.728   2.263  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.116   9.177   1.841  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.138   7.614   0.988  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.609   7.231   3.142  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -3.457   9.053  -0.519  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.035   9.561   0.152  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.462  10.248   0.617  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.343   6.163   1.960  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.040   4.755   1.755  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.307   3.897   1.647  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.286   4.112   2.357  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.186   4.249   2.919  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.210   4.772   2.940  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.675   5.768   3.727  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.356   4.274   2.189  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       2.028   5.938   3.496  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.512   4.991   2.614  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.538   3.252   1.231  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.796   4.681   2.146  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.825   2.916   0.767  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.952   3.623   1.229  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.584   6.466   2.894  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.507   4.664   0.813  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.680   4.488   3.863  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.117   3.162   2.864  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.074   6.336   4.427  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.590   6.649   3.944  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.676   2.699   0.893  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.652   5.242   2.489  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.961   2.091   0.081  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.937   3.351   0.880  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.235   2.864   0.805  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.282   1.868   0.557  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.703   0.458   0.649  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.586   0.210   0.191  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.935   2.076  -0.821  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -3.982   2.152  -1.861  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.783   3.348  -0.863  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.368   2.747   0.289  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.057   1.964   1.317  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.591   1.228  -1.022  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -3.224   2.678  -1.569  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.134   3.513  -1.879  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.648   3.232  -0.209  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -5.200   4.210  -0.543  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.452  -0.458   1.270  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.107  -1.877   1.365  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.524  -2.637   0.103  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.709  -2.708  -0.236  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.777  -2.494   2.600  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.656  -3.989   2.695  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.525  -4.888   2.179  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.571  -4.775   3.272  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -5.083  -6.169   2.445  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.875  -6.158   3.110  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.352  -4.453   3.902  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -3.016  -7.174   3.557  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.470  -5.461   4.334  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.797  -6.818   4.160  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.369  -0.195   1.597  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.026  -1.975   1.481  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.323  -2.056   3.490  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.836  -2.230   2.609  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.430  -4.627   1.641  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.589  -7.001   2.176  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.092  -3.412   4.032  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.278  -8.212   3.422  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.530  -5.189   4.792  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.103  -7.583   4.479  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.566  -3.319  -0.526  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.826  -4.106  -1.718  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.926  -5.348  -1.745  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.771  -5.284  -1.338  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -3.709  -3.237  -2.989  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.504  -2.289  -3.110  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.147  -2.977  -3.245  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -0.942  -3.639  -4.286  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -0.326  -2.802  -2.317  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.618  -3.336  -0.144  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.870  -4.398  -1.658  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.756  -3.879  -3.870  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -4.596  -2.602  -3.017  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.658  -1.674  -3.998  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.487  -1.619  -2.249  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.436  -6.483  -2.235  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.662  -7.695  -2.562  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.688  -8.241  -1.472  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.786  -9.010  -1.800  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.973  -7.414  -3.919  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.798  -8.636  -4.811  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.436  -8.765  -5.842  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.933  -9.558  -4.449  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.389  -6.451  -2.563  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.390  -8.491  -2.728  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.569  -6.700  -4.491  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.000  -6.954  -3.744  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.526  -9.493  -3.514  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -0.814 -10.340  -5.065  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.840  -7.868  -0.190  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.942  -8.260   0.913  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.089  -7.192   1.304  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.004  -7.479   2.076  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.550  -7.176  -0.004  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.542  -8.481   1.791  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7      -0.400  -9.173   0.659  1.00  0.00           H  
+ATOM    112  N   LYS A   8      -0.034  -5.983   0.746  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.925  -4.881   0.810  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.167  -3.541   0.925  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -1.065  -3.496   0.898  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       1.794  -5.026  -0.462  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.058  -4.165  -0.615  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.166  -4.503   0.393  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.074  -3.687   1.684  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       5.069  -4.146   2.668  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.815  -5.829   0.109  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.540  -5.011   1.701  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.123  -6.066  -0.525  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.161  -4.853  -1.334  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.456  -4.371  -1.610  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       2.821  -3.105  -0.585  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.147  -5.570   0.619  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       5.127  -4.275  -0.072  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.269  -2.642   1.444  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       3.079  -3.774   2.116  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       5.932  -4.369   2.193  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       5.239  -3.415   3.345  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       4.726  -4.971   3.140  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.901  -2.432   1.045  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.367  -1.066   1.001  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.841  -0.349  -0.271  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.001  -0.493  -0.654  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.823  -0.263   2.232  1.00  0.00           C  
+ATOM    139  CG  TRP A   9       0.236  -0.647   3.554  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.852  -1.390   4.501  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.038  -0.228   4.135  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9       0.057  -1.450   5.629  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.098  -0.711   5.476  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.129   0.551   3.688  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.156  -0.398   6.342  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.204   0.859   4.540  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.218   0.393   5.866  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.902  -2.534   1.012  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.721  -1.091   1.006  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.914  -0.271   2.318  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.539   0.775   2.072  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.837  -1.827   4.397  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9       0.320  -1.933   6.476  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.143   0.942   2.685  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.148  -0.748   7.364  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.015   1.477   4.177  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.039   0.651   6.519  1.00  0.00           H  
+ATOM    158  N   THR A  10      -0.004   0.517  -0.849  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.383   1.446  -1.927  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.228   2.837  -1.733  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.296   2.985  -1.132  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.070   0.865  -3.315  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.818   1.584  -4.266  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.393   0.951  -3.749  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.960   0.556  -0.497  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.465   1.573  -1.883  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.383  -0.179  -3.342  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.379   1.490  -5.114  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.524   0.426  -4.697  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -2.026   0.486  -2.996  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.703   1.989  -3.874  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.470   3.877  -2.199  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.025   5.270  -2.095  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.933   5.610  -3.242  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.693   5.229  -4.388  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.230   6.217  -2.102  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       0.915   7.666  -1.852  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       0.859   8.652  -2.779  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.669   8.316  -0.571  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.612   9.862  -2.154  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.505   9.716  -0.785  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.610   7.857   0.759  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.315  10.620   0.274  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.426   8.752   1.827  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.287  10.131   1.591  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.277   3.669  -2.771  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.481   5.409  -1.140  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       1.909   5.894  -1.312  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       1.766   6.129  -3.046  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.023   8.514  -3.841  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.592  10.748  -2.642  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.735   6.802   0.949  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.219  11.680   0.084  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.412   8.375   2.838  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.174  10.808   2.426  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.996   6.360  -2.934  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -3.086   6.664  -3.871  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.615   8.106  -3.781  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -4.429   8.525  -4.593  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -4.184   5.607  -3.655  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.965   5.314  -4.942  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.986   4.198  -4.699  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.691   3.831  -6.003  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.815   2.913  -5.757  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.131   6.568  -1.946  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.703   6.552  -4.888  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.720   4.670  -3.343  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.861   5.930  -2.862  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.482   6.213  -5.280  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -4.264   4.994  -5.714  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.482   3.314  -4.307  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.727   4.545  -3.978  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.073   4.742  -6.464  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.978   3.360  -6.682  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -8.399   2.865  -6.579  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -7.461   1.992  -5.536  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -8.359   3.258  -4.978  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.148   8.903  -2.827  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.467   8.562  -2.169  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -3.482   9.852  -2.816  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        5                                                                  
+ATOM      1  N   SER A   1      -2.518   9.773   0.749  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.004   8.718   1.661  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.581   7.323   1.183  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.212   7.126   0.021  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.528   8.790   1.812  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.959  10.099   2.140  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.548   8.889   2.636  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.988   8.498   0.868  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.855   8.098   2.590  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -4.944  10.226   3.092  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -1.679   9.458   0.283  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.314  10.608   1.279  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.232   9.980   0.065  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.611   6.346   2.100  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.266   4.947   1.831  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.505   4.048   1.695  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.499   4.245   2.390  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.356   4.423   2.957  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.030   4.998   3.021  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.448   5.993   3.839  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.223   4.544   2.309  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.804   6.203   3.658  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.337   5.320   2.743  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.481   3.516   1.377  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.637   5.110   2.259  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.784   3.281   0.893  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.858   4.081   1.325  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.955   6.559   3.024  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.734   4.907   0.884  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.849   4.585   3.919  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.252   3.341   2.855  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.179   6.546   4.525  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.339   6.906   4.150  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.660   2.891   1.068  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.454   5.727   2.604  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.967   2.472   0.200  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.855   3.893   0.949  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.407   3.013   0.849  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.420   1.958   0.641  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.769   0.567   0.616  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.595   0.435   0.264  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.207   2.186  -0.662  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -4.333   2.232  -1.767  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -6.032   3.473  -0.661  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.531   2.908   0.341  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.131   1.975   1.468  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.900   1.354  -0.798  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -3.541   2.716  -1.510  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -5.388   4.346  -0.551  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.569   3.544  -1.606  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.755   3.449   0.154  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.506  -0.468   1.043  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.021  -1.853   1.134  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.217  -2.630  -0.173  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.304  -2.634  -0.758  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.747  -2.580   2.272  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.481  -4.057   2.387  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.253  -5.020   1.834  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.404  -4.765   3.078  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.778  -6.265   2.196  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.655  -6.166   2.991  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.241  -4.372   3.772  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.839  -7.118   3.619  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.395  -5.316   4.384  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.702  -6.686   4.326  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.476  -0.313   1.274  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.956  -1.845   1.369  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.480  -2.102   3.215  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.821  -2.450   2.132  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.132  -4.825   1.231  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.236  -7.127   1.937  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.992  -3.326   3.804  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.075  -8.170   3.554  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.502  -4.987   4.897  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.049  -7.400   4.808  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.192  -3.381  -0.577  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.203  -4.152  -1.804  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.370  -5.436  -1.640  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.167  -5.365  -1.389  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.665  -3.272  -2.945  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.880  -3.887  -4.336  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.762  -3.475  -5.293  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -1.729  -2.277  -5.653  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -0.952  -4.364  -5.637  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.340  -3.408  -0.014  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.242  -4.381  -2.028  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.178  -2.308  -2.931  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.603  -3.086  -2.782  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.916  -4.975  -4.274  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.838  -3.545  -4.732  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.000  -6.611  -1.776  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.334  -7.914  -1.924  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.186  -8.222  -0.934  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.152  -8.766  -1.318  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.938  -8.046  -3.413  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -3.145  -8.279  -4.311  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -4.196  -8.736  -3.887  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -3.040  -7.977  -5.587  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.997  -6.601  -1.930  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.074  -8.688  -1.717  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -1.420  -7.140  -3.730  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.261  -8.887  -3.549  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -2.203  -7.585  -5.983  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -3.864  -8.183  -6.124  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.382  -7.919   0.356  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.405  -8.205   1.415  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.500  -7.019   1.759  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.312  -7.131   2.675  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.234  -7.442   0.609  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.928  -8.509   2.318  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.233  -9.038   1.117  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.365  -5.899   1.037  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.173  -4.684   1.167  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.290  -3.426   1.186  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.931  -3.490   1.059  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.226  -4.694   0.034  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.443  -5.525   0.471  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.452  -5.755  -0.658  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.713  -6.393  -0.064  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       6.688  -6.765  -1.102  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.321  -5.894   0.284  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.689  -4.704   2.128  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       1.791  -5.116  -0.876  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       2.565  -3.682  -0.192  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.935  -5.002   1.293  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.116  -6.500   0.830  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.015  -6.428  -1.398  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.709  -4.807  -1.132  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       6.179  -5.685   0.623  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       5.429  -7.287   0.492  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       6.243  -7.364  -1.784  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       7.034  -5.933  -1.556  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       7.458  -7.258  -0.672  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.922  -2.263   1.352  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.292  -0.942   1.290  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.878  -0.172   0.096  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.062  -0.318  -0.208  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.524  -0.160   2.603  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.178  -0.608   3.860  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.389  -1.304   4.873  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.521  -0.262   4.330  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.497  -1.401   5.930  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.680  -0.746   5.662  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.600   0.474   3.793  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.834  -0.495   6.426  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.768   0.715   4.535  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.882   0.246   5.854  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.930  -2.280   1.357  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.781  -1.046   1.134  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.596  -0.105   2.812  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.200   0.867   2.429  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.407  -1.674   4.876  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.263  -1.829   6.814  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.524   0.884   2.802  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.914  -0.850   7.443  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.576   1.284   4.094  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.774   0.465   6.425  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.069   0.681  -0.539  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.446   1.556  -1.665  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.192   2.951  -1.527  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.281   3.099  -0.963  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.108   0.867  -2.999  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.529   1.687  -4.061  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.371   0.515  -3.188  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.908   0.707  -0.248  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.528   1.711  -1.663  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.677  -0.062  -3.054  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.296   1.249  -4.883  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.648  -0.280  -2.494  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -2.003   1.383  -3.008  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.543   0.156  -4.203  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.536   3.999  -1.939  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.088   5.397  -1.876  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.870   5.718  -3.032  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.751   5.154  -4.120  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.312   6.331  -1.883  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.043   7.805  -1.739  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       0.977   8.709  -2.744  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.852   8.571  -0.512  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.751   9.971  -2.221  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.702   9.949  -0.841  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.807   8.234   0.852  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.559  10.946   0.140  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.658   9.214   1.847  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.556  10.574   1.497  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.389   3.804  -2.443  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.447   5.551  -0.939  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       1.958   6.036  -1.053  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       1.883   6.173  -2.797  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.097   8.480  -3.795  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.668  10.805  -2.786  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.901   7.197   1.119  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.460  11.984  -0.144  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.636   8.909   2.880  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.469  11.323   2.270  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.784   6.673  -2.819  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.902   6.951  -3.729  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.969   8.436  -4.111  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.512   9.263  -3.389  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -4.192   6.440  -3.067  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -5.418   6.554  -3.991  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -6.710   6.594  -3.170  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -7.910   6.840  -4.088  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -9.077   7.329  -3.336  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.811   7.091  -1.890  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.767   6.382  -4.651  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.064   5.391  -2.793  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.358   7.012  -2.153  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.364   7.474  -4.574  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -5.433   5.709  -4.682  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -6.842   5.659  -2.627  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.639   7.416  -2.455  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.638   7.594  -4.827  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -8.171   5.916  -4.605  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -9.843   7.489  -3.974  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -9.349   6.647  -2.643  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -8.838   8.197  -2.877  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.432   8.785  -5.273  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.972   8.103  -5.854  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.529   9.745  -5.556  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        6                                                                  
+ATOM      1  N   SER A   1      -2.130   8.920  -0.599  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -2.737   8.199   0.535  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.459   6.705   0.460  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.395   6.113  -0.621  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.246   8.457   0.657  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.911   8.463  -0.593  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.277   8.566   1.449  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.697   7.695   1.296  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.389   9.432   1.128  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.826   8.733  -0.455  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -1.131   8.775  -0.591  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.334   9.904  -0.521  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.514   8.562  -1.461  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.178   6.099   1.616  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.014   4.656   1.717  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.336   3.883   1.605  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.296   4.163   2.321  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.294   4.318   3.025  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.115   4.830   3.150  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.534   5.812   3.984  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.324   4.315   2.510  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.909   5.942   3.899  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.450   5.023   3.025  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.581   3.296   1.571  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.768   4.726   2.636  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.895   2.971   1.188  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.988   3.687   1.715  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.206   6.628   2.476  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.424   4.351   0.863  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.887   4.698   3.863  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.265   3.228   3.129  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.105   6.402   4.628  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.443   6.590   4.456  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.745   2.745   1.185  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.598   5.283   3.043  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.074   2.157   0.500  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.995   3.430   1.410  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.366   2.926   0.673  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.404   1.902   0.506  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.769   0.500   0.513  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.563   0.357   0.315  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.184   2.149  -0.792  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -6.280   1.265  -0.837  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -4.347   1.963  -2.064  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.527   2.785   0.116  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.121   1.949   1.333  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.573   3.170  -0.780  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -6.815   1.493  -1.602  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -3.634   2.783  -2.139  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -3.801   1.022  -2.040  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -4.994   1.965  -2.941  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.552  -0.533   0.832  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.090  -1.919   0.995  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.403  -2.783  -0.240  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.570  -2.982  -0.581  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.741  -2.496   2.262  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.476  -3.949   2.516  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.258  -4.963   2.081  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.377  -4.572   3.246  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.730  -6.169   2.496  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.575  -5.985   3.227  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.228  -4.093   3.910  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.695  -6.882   3.845  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.334  -4.986   4.525  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.572  -6.371   4.510  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.545  -0.354   0.891  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.011  -1.927   1.151  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.394  -1.922   3.122  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.820  -2.351   2.195  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.160  -4.830   1.491  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.160  -7.065   2.306  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.053  -3.037   3.958  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.868  -7.955   3.801  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.464  -4.610   5.045  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.863  -7.049   4.983  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.374  -3.379  -0.860  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.530  -4.301  -1.994  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.507  -5.443  -1.888  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.450  -5.236  -1.305  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -3.345  -3.533  -3.324  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.548  -4.382  -4.596  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -4.837  -5.209  -4.583  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -5.908  -4.608  -4.356  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -4.725  -6.440  -4.785  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.432  -3.275  -0.476  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.546  -4.691  -1.963  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -4.052  -2.704  -3.352  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -2.338  -3.113  -3.357  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -3.565  -3.722  -5.464  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.693  -5.047  -4.721  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.732  -6.606  -2.517  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -1.772  -7.717  -2.689  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -0.883  -8.082  -1.468  1.00  0.00           C  
+ATOM     94  O   ASN A   6       0.213  -8.607  -1.647  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -0.999  -7.578  -4.029  1.00  0.00           C  
+ATOM     96  CG  ASN A   6       0.168  -6.587  -4.125  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6       1.148  -6.842  -4.806  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6       0.102  -5.407  -3.546  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.585  -6.679  -3.058  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.393  -8.603  -2.827  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -0.580  -8.557  -4.264  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.702  -7.339  -4.826  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.589  -5.210  -2.829  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6       0.878  -4.798  -3.725  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.358  -7.843  -0.238  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.627  -8.112   1.000  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.147  -6.919   1.594  1.00  0.00           C  
+ATOM    108  O   GLY A   7       0.744  -7.072   2.665  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.252  -7.382  -0.175  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.335  -8.454   1.755  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.079  -8.929   0.836  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.148  -5.736   0.955  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.919  -4.590   1.429  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.178  -3.246   1.310  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.775  -3.096   0.539  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.280  -4.539   0.712  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.187  -4.329  -0.808  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.586  -4.251  -1.434  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       3.497  -3.907  -2.923  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       3.075  -2.510  -3.136  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.397  -5.632   0.098  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.134  -4.810   2.470  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.866  -3.722   1.141  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       2.818  -5.470   0.910  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.650  -5.163  -1.257  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.648  -3.406  -1.010  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.186  -3.494  -0.925  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.082  -5.218  -1.324  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.476  -4.048  -3.379  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       2.786  -4.581  -3.402  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       2.984  -2.326  -4.124  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       2.185  -2.347  -2.682  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.766  -1.888  -2.738  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.654  -2.229   2.042  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.221  -0.841   1.838  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.881  -0.265   0.574  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.053  -0.510   0.296  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.547   0.038   3.055  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.262  -0.216   4.298  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.222  -0.729   5.449  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.676   0.073   4.548  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.781  -0.769   6.392  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.977  -0.303   5.885  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.731   0.638   3.793  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.258  -0.155   6.441  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -4.021   0.781   4.333  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.290   0.378   5.651  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.475  -2.401   2.602  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.853  -0.839   1.684  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.615  -0.039   3.287  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.369   1.082   2.789  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.252  -1.020   5.611  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.637  -1.065   7.349  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.565   0.984   2.786  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.450  -0.430   7.472  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.811   1.210   3.732  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.285   0.504   6.061  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.125   0.542  -0.170  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.478   1.149  -1.455  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.018   2.604  -1.458  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.155   2.868  -1.066  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.186   0.319  -2.570  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.324  -0.999  -2.543  1.00  0.00           O  
+ATOM    164  CG2 THR A  10       0.048   0.843  -3.986  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.846   0.661   0.115  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.560   1.138  -1.598  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -1.261   0.284  -2.384  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.240  -1.328  -1.643  1.00  0.00           H  
+ATOM    169 HG21 THR A  10       1.089   0.687  -4.275  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -0.596   0.286  -4.670  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -0.202   1.900  -4.054  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.839   3.572  -1.814  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.464   4.988  -1.942  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.268   5.225  -3.275  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.343   5.189  -4.341  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.705   5.875  -1.757  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.485   7.358  -1.671  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.494   8.222  -2.716  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.329   8.179  -0.474  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.419   9.520  -2.239  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.368   9.551  -0.860  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.189   7.905   0.900  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       1.353  10.597   0.077  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       1.124   8.940   1.850  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       1.233  10.282   1.444  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.784   3.323  -2.067  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.207   5.243  -1.124  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.183   5.579  -0.822  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.428   5.680  -2.547  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.608   7.930  -3.758  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.456  10.340  -2.834  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.151   6.876   1.212  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       1.436  11.627  -0.245  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       1.015   8.701   2.894  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       1.228  11.076   2.180  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.590   5.434  -3.200  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.519   5.585  -4.338  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.577   6.678  -4.115  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -4.175   7.177  -5.059  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.218   4.234  -4.590  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.670   4.048  -6.046  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -4.449   2.740  -6.257  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -5.925   2.875  -5.868  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -6.703   1.717  -6.343  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.967   5.450  -2.256  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.953   5.864  -5.227  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -2.531   3.421  -4.350  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.086   4.159  -3.934  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.289   4.887  -6.366  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -2.779   4.022  -6.675  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -4.394   2.479  -7.315  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -3.994   1.934  -5.679  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.010   2.950  -4.784  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -6.335   3.781  -6.319  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -6.822   1.783  -7.344  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -6.206   0.865  -6.124  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.609   1.705  -5.898  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.822   7.073  -2.873  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -3.328   6.657  -2.093  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -4.522   7.778  -2.695  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        7                                                                  
+ATOM      1  N   SER A   1      -3.506   8.785   2.641  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.293   8.448   1.217  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.638   7.069   0.984  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.120   6.806  -0.113  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -2.456   9.544   0.562  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -2.579   9.450  -0.837  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -4.270   8.437   0.735  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -2.771  10.531   0.902  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -1.423   9.386   0.842  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -2.325   8.544  -1.059  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -4.251   9.464   2.711  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.662   9.185   3.027  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.763   7.960   3.163  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.677   6.169   1.977  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.207   4.792   1.862  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.406   3.837   1.768  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.326   3.957   2.573  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.314   4.458   3.081  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.098   4.979   3.054  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.585   6.015   3.778  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.246   4.439   2.329  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.941   6.152   3.544  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.402   5.204   2.657  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.431   3.352   1.454  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.667   4.936   2.111  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.699   3.051   0.914  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.812   3.854   1.225  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -3.181   6.384   2.826  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.645   4.712   0.937  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.802   4.824   3.986  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.251   3.374   3.207  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.008   6.637   4.450  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.521   6.854   3.979  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.571   2.750   1.222  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.516   5.553   2.367  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.824   2.208   0.251  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.776   3.637   0.788  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.380   2.880   0.825  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.385   1.802   0.671  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.746   0.425   0.847  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.548   0.258   0.612  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.118   1.891  -0.682  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -6.265   1.076  -0.619  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -4.323   1.450  -1.918  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.571   2.834   0.208  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.159   1.899   1.437  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.444   2.920  -0.828  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -6.041   0.198  -0.947  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -3.504   2.143  -2.100  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -3.921   0.444  -1.793  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -4.978   1.451  -2.790  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.535  -0.566   1.272  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.114  -1.966   1.291  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.380  -2.639  -0.061  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.485  -2.568  -0.600  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.817  -2.689   2.449  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.488  -4.141   2.624  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.249  -5.168   2.182  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.353  -4.753   3.314  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.679  -6.367   2.563  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.516  -6.168   3.275  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.205  -4.263   3.975  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.619  -7.046   3.895  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.283  -5.137   4.580  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.493  -6.525   4.551  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.510  -0.362   1.444  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.039  -1.985   1.455  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.561  -2.178   3.378  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.896  -2.599   2.318  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.179  -5.054   1.640  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.103  -7.268   2.391  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.036  -3.200   4.014  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.794  -8.111   3.878  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.406  -4.744   5.074  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.780  -7.190   5.019  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.351  -3.287  -0.615  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.350  -3.897  -1.936  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.566  -5.220  -1.889  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.395  -5.216  -1.527  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.687  -2.902  -2.900  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.724  -3.351  -4.363  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.940  -2.375  -5.240  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -2.457  -1.256  -5.452  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -0.832  -2.760  -5.674  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.431  -3.226  -0.178  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.382  -4.060  -2.248  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.188  -1.935  -2.820  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.648  -2.771  -2.602  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.289  -4.346  -4.456  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.760  -3.392  -4.702  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.182  -6.357  -2.249  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.503  -7.654  -2.423  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.565  -8.084  -1.258  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.531  -8.712  -1.497  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.794  -7.638  -3.800  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.678  -9.013  -4.449  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.294  -9.292  -5.463  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.898  -9.906  -3.882  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.142  -6.294  -2.552  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.287  -8.412  -2.475  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.347  -7.003  -4.493  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.796  -7.210  -3.690  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.453  -9.659  -2.996  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -0.833 -10.810  -4.316  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.893  -7.761   0.003  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -1.013  -8.053   1.144  1.00  0.00           C  
+ATOM    107  C   GLY A   7      -0.063  -6.908   1.549  1.00  0.00           C  
+ATOM    108  O   GLY A   7       0.784  -7.116   2.419  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.755  -7.264   0.161  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.606  -8.365   2.000  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7      -0.385  -8.913   0.905  1.00  0.00           H  
+ATOM    112  N   LYS A   8      -0.146  -5.727   0.911  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.852  -4.660   1.035  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.215  -3.256   1.082  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.722  -2.974   0.331  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       1.784  -4.814  -0.185  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.223  -4.342   0.062  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.093  -4.530  -1.198  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.254  -3.265  -2.053  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       2.980  -2.575  -2.325  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.803  -5.639   0.136  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.416  -4.853   1.946  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       1.841  -5.870  -0.458  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.351  -4.287  -1.037  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.236  -3.300   0.382  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.643  -4.954   0.864  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       5.091  -4.839  -0.885  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       3.689  -5.333  -1.817  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.919  -2.575  -1.533  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.714  -3.541  -3.003  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       2.372  -3.174  -2.865  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       2.530  -2.345  -1.450  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.157  -1.723  -2.837  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.720  -2.334   1.916  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.299  -0.923   1.837  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.934  -0.231   0.625  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.130  -0.371   0.380  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.604  -0.120   3.110  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.174  -0.521   4.327  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.324  -1.214   5.374  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.550  -0.178   4.688  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.646  -1.340   6.348  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.804  -0.681   5.997  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.585   0.569   4.082  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.015  -0.462   6.672  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.804   0.798   4.748  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.021   0.284   6.037  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.498  -2.580   2.506  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.782  -0.906   1.709  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.675  -0.124   3.328  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.341   0.919   2.910  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.337  -1.587   5.440  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.498  -1.809   7.230  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.433   1.010   3.112  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.168  -0.866   7.661  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.577   1.376   4.263  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.961   0.466   6.542  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.134   0.576  -0.080  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.450   1.175  -1.387  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.061   2.632  -1.437  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.200   2.900  -1.044  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.173   0.275  -2.475  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.249  -1.064  -2.302  1.00  0.00           O  
+ATOM    164  CG2 THR A  10       0.265   0.647  -3.886  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.843   0.621   0.210  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.529   1.183  -1.553  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -1.261   0.312  -2.411  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -0.247  -1.454  -1.574  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -0.124   1.627  -4.157  1.00  0.00           H  
+ATOM    170 HG22 THR A  10       1.354   0.641  -3.948  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -0.126  -0.098  -4.577  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.800   3.607  -1.784  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.410   5.026  -1.914  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.460   5.224  -3.159  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.038   4.887  -4.265  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.631   5.963  -1.973  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.311   7.436  -1.934  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.164   8.261  -2.998  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.133   8.287  -0.762  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.928   9.554  -2.557  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.937   9.634  -1.179  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.135   8.047   0.622  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.798  10.692  -0.261  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.992   9.085   1.557  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.843  10.416   1.120  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.747   3.359  -2.035  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.169   5.305  -1.033  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.275   5.742  -1.120  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.216   5.759  -2.868  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.246   7.953  -4.034  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.810  10.348  -3.172  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.262   7.035   0.945  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.643  11.703  -0.609  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.992   8.845   2.608  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.730  11.213   1.843  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.657   5.799  -2.982  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.672   5.920  -4.045  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.908   7.351  -4.553  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.689   7.557  -5.472  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.960   5.184  -3.624  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.591   5.582  -2.275  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.160   7.009  -2.187  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.256   7.300  -3.221  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.410   6.395  -3.081  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.918   6.043  -2.030  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.308   5.388  -4.926  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.705   5.281  -4.414  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -3.716   4.122  -3.557  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.399   4.883  -2.068  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.857   5.446  -1.482  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.574   7.155  -1.189  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -4.356   7.732  -2.311  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.598   8.327  -3.088  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.845   7.199  -4.226  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -7.754   6.429  -2.131  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -8.144   6.678  -3.714  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.124   5.451  -3.299  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.239   8.353  -3.996  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.581   8.183  -3.253  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.419   9.280  -4.346  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        8                                                                  
+ATOM      1  N   SER A   1      -4.958   7.757   1.946  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -4.062   7.738   0.774  1.00  0.00           C  
+ATOM      3  C   SER A   1      -3.452   6.346   0.630  1.00  0.00           C  
+ATOM      4  O   SER A   1      -3.698   5.657  -0.365  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -2.984   8.823   0.874  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -2.063   8.675  -0.185  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -4.659   7.947  -0.113  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -3.446   9.812   0.839  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -2.444   8.723   1.816  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -2.382   9.154  -0.999  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -4.513   7.273   2.714  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -5.819   7.280   1.714  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -5.159   8.708   2.218  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.615   5.943   1.597  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.167   4.564   1.722  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.358   3.591   1.652  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.294   3.697   2.440  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.345   4.366   3.004  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.005   5.026   3.090  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.345   5.992   3.976  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.251   4.657   2.414  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.700   6.246   3.893  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.322   5.396   3.004  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.601   3.716   1.419  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.667   5.188   2.655  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.948   3.490   1.064  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.979   4.218   1.687  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.383   6.571   2.350  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.549   4.358   0.866  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.948   4.682   3.858  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.175   3.296   3.127  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.337   6.456   4.680  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.182   6.928   4.466  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.819   3.136   0.961  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.450   5.762   3.128  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.195   2.737   0.330  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       5.010   4.028   1.420  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.340   2.692   0.662  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.392   1.715   0.341  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.818   0.302   0.431  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.663   0.096   0.063  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.895   1.986  -1.086  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.431   3.289  -1.146  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.970   1.010  -1.584  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.550   2.734   0.020  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.224   1.811   1.040  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.045   1.929  -1.766  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.759   3.919  -0.842  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.153   1.193  -2.641  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -5.644  -0.026  -1.487  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.900   1.154  -1.033  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.607  -0.664   0.914  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.209  -2.068   1.037  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.596  -2.886  -0.202  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.783  -3.076  -0.489  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.832  -2.668   2.301  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.562  -4.133   2.486  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.323  -5.123   1.969  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.464  -4.795   3.185  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.781  -6.347   2.295  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.633  -6.205   3.043  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.345  -4.358   3.929  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.742  -7.134   3.598  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.441  -5.283   4.489  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.637  -6.666   4.324  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.550  -0.433   1.190  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.128  -2.122   1.154  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.454  -2.129   3.170  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.914  -2.523   2.267  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.215  -4.958   1.374  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.196  -7.229   2.033  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.189  -3.300   4.072  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.905  -8.193   3.465  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.590  -4.931   5.056  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.936  -7.366   4.758  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.605  -3.483  -0.868  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.827  -4.420  -1.965  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.877  -5.623  -1.840  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.699  -5.459  -1.540  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -3.773  -3.735  -3.349  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.772  -2.583  -3.544  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.313  -2.993  -3.355  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -0.837  -3.807  -4.177  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -0.690  -2.470  -2.404  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.646  -3.367  -0.535  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.851  -4.774  -1.864  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.599  -4.494  -4.114  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -4.764  -3.322  -3.545  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.891  -2.194  -4.556  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.021  -1.773  -2.857  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.414  -6.837  -2.051  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.724  -8.138  -2.114  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.482  -8.289  -1.190  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.460  -8.840  -1.599  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.461  -8.467  -3.606  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.340  -9.957  -3.933  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.964 -10.455  -4.854  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -1.537 -10.706  -3.209  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.393  -6.851  -2.286  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.443  -8.878  -1.756  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -3.291  -8.090  -4.204  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.558  -7.957  -3.939  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.962 -10.250  -2.501  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -1.433 -11.668  -3.482  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.573  -7.858   0.076  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.512  -8.042   1.076  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.376  -6.820   1.346  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.265  -6.923   2.192  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.408  -7.359   0.342  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.962  -8.343   2.019  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.143  -8.859   0.773  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.160  -5.679   0.672  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.988  -4.480   0.846  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.145  -3.200   0.919  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -1.043  -3.201   0.593  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.025  -4.420  -0.297  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.357  -3.802   0.168  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.478  -3.835  -0.880  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.029  -5.246  -1.124  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       4.351  -5.925  -2.242  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.583  -5.640  -0.026  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.525  -4.591   1.789  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.221  -5.433  -0.648  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.622  -3.844  -1.134  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.194  -2.761   0.439  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.704  -4.330   1.057  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.138  -3.389  -1.816  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       5.300  -3.227  -0.500  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       6.089  -5.170  -1.362  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.919  -5.839  -0.215  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       4.435  -5.361  -3.075  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.782  -6.825  -2.401  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.375  -6.053  -2.020  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.794  -2.097   1.304  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.258  -0.742   1.196  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.810  -0.093  -0.078  1.00  0.00           C  
+ATOM    137  O   TRP A   9       1.992  -0.251  -0.387  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.625   0.117   2.422  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.028  -0.276   3.711  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.555  -0.960   4.720  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.390   0.001   4.153  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.347  -1.110   5.759  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.570  -0.550   5.455  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.492   0.660   3.575  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.788  -0.450   6.151  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.716   0.767   4.258  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.866   0.220   5.545  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.784  -2.173   1.468  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.826  -0.798   1.139  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.708   0.150   2.563  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.312   1.141   2.214  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.578  -1.311   4.711  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.116  -1.552   6.637  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.374   1.079   2.592  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.895  -0.879   7.137  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.550   1.262   3.780  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.811   0.314   6.064  1.00  0.00           H  
+ATOM    158  N   THR A  10      -0.003   0.726  -0.750  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.396   1.600  -1.867  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.077   3.030  -1.602  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.112   3.219  -0.966  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.139   1.073  -3.205  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.375   1.895  -4.224  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.666   1.060  -3.328  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.979   0.750  -0.453  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.483   1.619  -1.940  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.232   0.059  -3.358  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -0.124   1.730  -5.026  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -2.093   0.446  -2.535  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -2.067   2.071  -3.256  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.954   0.630  -4.288  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.728   4.038  -1.956  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.378   5.451  -1.776  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.503   5.965  -2.922  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.335   5.535  -4.065  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.681   6.268  -1.667  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.556   7.754  -1.511  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.782   8.679  -2.475  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.233   8.509  -0.308  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.630   9.948  -1.944  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.292   9.902  -0.608  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.902   8.147   1.012  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       1.049  10.889   0.362  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.656   9.123   1.993  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.727  10.492   1.672  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.543   3.818  -2.508  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.201   5.529  -0.859  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.246   5.896  -0.811  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.291   6.083  -2.550  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       2.074   8.452  -3.493  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.792  10.797  -2.464  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.827   7.100   1.253  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       1.123  11.936   0.109  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.403   8.814   2.995  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.535  11.234   2.434  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.376   6.948  -2.645  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.271   7.561  -3.644  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.336   9.083  -3.498  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -2.635   9.607  -2.427  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.690   6.970  -3.557  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.740   5.474  -3.906  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.188   5.020  -4.113  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -5.239   3.545  -4.513  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -6.632   3.080  -4.611  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.426   7.293  -1.691  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.883   7.338  -4.639  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.103   7.129  -2.560  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.317   7.507  -4.270  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -3.183   5.302  -4.827  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.287   4.892  -3.101  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.754   5.170  -3.193  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.643   5.610  -4.909  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -4.751   3.421  -5.480  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -4.713   2.947  -3.769  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -6.650   2.123  -4.932  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -7.065   3.139  -3.700  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.136   3.666  -5.262  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.105   9.817  -4.577  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.872   9.394  -5.461  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.200  10.814  -4.473  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL        9                                                                  
+ATOM      1  N   SER A   1      -3.041   9.412   1.730  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.790   8.216   2.150  1.00  0.00           C  
+ATOM      3  C   SER A   1      -3.280   6.951   1.464  1.00  0.00           C  
+ATOM      4  O   SER A   1      -3.497   6.729   0.267  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -5.302   8.410   1.987  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.688   8.427   0.627  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.606   8.089   3.215  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.822   7.606   2.509  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.587   9.356   2.448  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.162   7.764   0.156  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -3.681  10.102   1.364  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.361   9.168   1.023  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.563   9.794   2.534  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.554   6.137   2.236  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.192   4.777   1.856  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.435   3.906   1.603  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.509   4.142   2.151  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.294   4.162   2.946  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.097   4.723   3.073  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.511   5.648   3.973  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.290   4.351   2.315  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.862   5.892   3.801  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.404   5.085   2.821  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.551   3.442   1.266  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.709   4.908   2.326  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.849   3.249   0.764  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.930   3.973   1.297  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.390   6.408   3.192  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.665   4.811   0.911  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.801   4.249   3.909  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.189   3.096   2.744  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.119   6.123   4.715  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.386   6.564   4.345  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.751   2.855   0.865  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.534   5.477   2.724  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.017   2.528  -0.023  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.925   3.803   0.911  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.260   2.874   0.776  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.282   1.949   0.280  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.692   0.543   0.241  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.629   0.343  -0.344  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.726   2.403  -1.120  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.551   3.531  -0.965  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.504   1.371  -1.941  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.336   2.787   0.353  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.143   1.957   0.949  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -3.846   2.692  -1.696  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.995   4.266  -0.689  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.370   1.010  -1.386  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -5.842   1.839  -2.866  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -4.857   0.534  -2.202  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.319  -0.422   0.918  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.841  -1.806   0.915  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.036  -2.496  -0.442  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.084  -2.397  -1.086  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.506  -2.582   2.050  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.216  -4.053   2.118  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.022  -5.020   1.628  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.131  -4.753   2.802  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.571  -6.256   2.050  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.433  -6.143   2.820  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -1.945  -4.359   3.450  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.659  -7.070   3.533  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.164  -5.265   4.188  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.536  -6.620   4.251  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.149  -0.204   1.448  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.772  -1.791   1.113  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.188  -2.139   2.995  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.587  -2.452   1.985  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -5.942  -4.828   1.088  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.106  -7.104   1.944  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.642  -3.342   3.335  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.935  -8.113   3.545  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.279  -4.921   4.706  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.943  -7.312   4.833  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.018  -3.257  -0.843  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -2.951  -4.001  -2.085  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.317  -5.358  -1.764  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.098  -5.469  -1.651  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.183  -3.202  -3.157  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.238  -3.840  -4.563  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.150  -4.879  -4.861  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5       0.025  -4.613  -4.524  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -1.509  -5.913  -5.470  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.229  -3.365  -0.207  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -3.976  -4.122  -2.436  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.652  -2.220  -3.234  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.150  -3.042  -2.847  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -3.220  -4.296  -4.710  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.138  -3.044  -5.303  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.170  -6.365  -1.538  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.854  -7.790  -1.404  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.500  -8.090  -0.718  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.571  -8.599  -1.342  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -3.002  -8.451  -2.794  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -4.383  -8.271  -3.418  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -5.365  -7.966  -2.758  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -4.505  -8.449  -4.719  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.155  -6.140  -1.549  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.617  -8.229  -0.762  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.256  -8.027  -3.466  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -2.812  -9.520  -2.702  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -3.726  -8.688  -5.309  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -5.435  -8.304  -5.072  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.403  -7.804   0.589  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.223  -8.083   1.419  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.679  -6.872   1.679  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.523  -6.933   2.573  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.185  -7.348   1.043  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.545  -8.484   2.379  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.389  -8.848   0.941  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.498  -5.782   0.921  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.298  -4.554   0.968  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.395  -3.311   0.944  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.827  -3.401   0.860  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.267  -4.561  -0.236  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.636  -3.919   0.059  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.834  -4.885   0.125  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.834  -5.866   1.308  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       4.088  -7.112   1.050  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.209  -5.827   0.191  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.865  -4.540   1.902  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.416  -5.578  -0.601  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.793  -4.010  -1.051  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.841  -3.210  -0.745  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.596  -3.345   0.984  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.933  -5.429  -0.816  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       5.725  -4.267   0.234  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.867  -6.141   1.520  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.422  -5.372   2.188  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       3.355  -7.211   1.741  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       3.680  -7.093   0.127  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       4.715  -7.901   1.125  1.00  0.00           H  
+ATOM    134  N   TRP A   9       1.008  -2.130   0.969  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.353  -0.826   0.878  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.884  -0.063  -0.348  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.066  -0.173  -0.672  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.657  -0.044   2.170  1.00  0.00           C  
+ATOM    139  CG  TRP A   9       0.040  -0.515   3.457  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.699  -1.173   4.435  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.302  -0.270   3.983  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.116  -1.295   5.539  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.360  -0.751   5.319  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.463   0.359   3.488  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.504  -0.628   6.120  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.630   0.468   4.268  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.657  -0.038   5.578  1.00  0.00           C  
+ATOM    148  H   TRP A   9       2.015  -2.125   0.982  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.726  -0.943   0.778  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.740  -0.002   2.319  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.333   0.984   2.038  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.729  -1.503   4.380  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9       0.184  -1.702   6.415  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.437   0.754   2.489  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.496  -0.999   7.135  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.517   0.932   3.858  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.562   0.024   6.166  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.049   0.788  -0.958  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.408   1.773  -1.998  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.177   3.147  -1.648  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.052   3.256  -0.789  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.020   1.312  -3.403  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.541   2.205  -4.343  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.536   1.239  -3.627  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.911   0.829  -0.620  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.493   1.889  -2.024  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.398   0.322  -3.583  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -0.137   2.463  -4.973  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -2.007   0.710  -2.799  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.974   2.236  -3.703  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.746   0.681  -4.540  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.353   4.219  -2.238  1.00  0.00           N  
+ATOM    173  CA  TRP A  11      -0.032   5.596  -1.917  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -1.003   6.198  -2.942  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.841   6.028  -4.151  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.236   6.452  -1.786  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.037   7.886  -1.391  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.077   8.927  -2.251  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.742   8.463  -0.079  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.954  10.111  -1.549  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.719   9.883  -0.210  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.454   7.937   1.199  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.461  10.739   0.873  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.125   8.783   2.278  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.134  10.179   2.118  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.012   4.051  -2.989  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.526   5.610  -0.947  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       1.892   5.989  -1.048  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       1.773   6.446  -2.734  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.220   8.836  -3.320  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.998  11.023  -1.979  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.463   6.867   1.335  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.478  11.811   0.737  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11      -0.144   8.358   3.233  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11      -0.131  10.822   2.947  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.957   6.983  -2.429  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.868   7.865  -3.164  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.822   9.256  -2.522  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -2.473   9.420  -1.356  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -4.304   7.299  -3.142  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.537   6.186  -4.176  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.822   5.384  -3.919  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -7.112   6.175  -4.161  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -8.193   5.306  -4.664  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.013   7.070  -1.420  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.530   7.961  -4.198  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.520   6.921  -2.143  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -5.010   8.103  -3.353  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.582   6.625  -5.175  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.700   5.488  -4.150  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.809   4.508  -4.569  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.827   5.040  -2.890  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.430   6.638  -3.225  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -6.920   6.957  -4.894  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -8.621   5.739  -5.470  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -7.807   4.413  -4.935  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -8.889   5.166  -3.946  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.206  10.272  -3.280  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -3.513  10.104  -4.223  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -3.169  11.199  -2.885  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       10                                                                  
+ATOM      1  N   SER A   1      -4.764   7.974   1.674  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.472   8.065   0.965  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.888   6.677   0.739  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.753   6.245  -0.408  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -2.479   8.953   1.722  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -2.389  10.210   1.096  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.653   8.501  -0.016  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -2.802   9.083   2.756  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -1.493   8.491   1.724  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -1.635  10.196   0.496  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -5.309   8.807   1.501  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -4.602   7.880   2.666  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -5.272   7.163   1.348  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.535   5.988   1.828  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.169   4.579   1.807  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.415   3.690   1.608  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.439   3.897   2.256  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.415   4.240   3.099  1.00  0.00           C  
+ATOM     19  CG  TRP A   2      -0.023   4.803   3.199  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.359   5.846   3.975  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.203   4.316   2.561  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.728   6.017   3.881  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.305   5.070   3.064  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.504   3.301   1.629  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.633   4.797   2.706  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.836   3.002   1.275  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.901   3.740   1.820  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.664   6.399   2.740  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.490   4.423   0.978  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -2.001   4.575   3.957  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.331   3.156   3.179  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.296   6.443   4.594  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.243   6.743   4.359  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.693   2.739   1.198  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.441   5.381   3.122  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.049   2.205   0.577  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.919   3.499   1.549  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.315   2.693   0.722  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.360   1.710   0.370  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.807   0.284   0.482  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.645   0.061   0.149  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.877   1.940  -1.063  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -3.833   1.988  -2.012  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.640   3.258  -1.211  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.459   2.652   0.174  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.204   1.803   1.055  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.553   1.124  -1.321  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -3.170   1.293  -1.852  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.451   3.308  -0.484  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -4.963   4.100  -1.059  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.061   3.318  -2.215  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.588  -0.673   1.001  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.152  -2.069   1.114  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.277  -2.824  -0.219  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.361  -2.933  -0.793  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.912  -2.754   2.266  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.604  -4.205   2.516  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.329  -5.249   2.050  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.532  -4.799   3.313  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.773  -6.436   2.486  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.638  -6.218   3.234  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.473  -4.290   4.094  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.723  -7.080   3.857  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.554  -5.139   4.736  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.672  -6.533   4.609  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.526  -0.449   1.295  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.092  -2.058   1.349  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.691  -2.210   3.185  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.984  -2.662   2.082  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.213  -5.155   1.431  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.175  -7.344   2.302  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.375  -3.225   4.193  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.842  -8.151   3.783  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.754  -4.721   5.331  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.959  -7.179   5.103  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.154  -3.369  -0.698  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.039  -4.068  -1.974  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.147  -5.308  -1.790  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.012  -5.164  -1.349  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.465  -3.100  -3.031  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.244  -3.722  -4.422  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -3.485  -4.428  -4.970  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -4.346  -3.721  -5.536  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -3.555  -5.666  -4.815  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.299  -3.288  -0.145  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.044  -4.352  -2.280  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.144  -2.252  -3.138  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.508  -2.714  -2.679  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -1.961  -2.926  -5.115  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -1.413  -4.428  -4.377  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.647  -6.514  -2.103  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -1.919  -7.800  -2.117  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -0.816  -7.961  -1.039  1.00  0.00           C  
+ATOM     94  O   ASN A   6       0.312  -8.348  -1.341  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.399  -8.081  -3.549  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.453  -8.618  -4.504  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -3.472  -9.167  -4.115  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -2.213  -8.517  -5.796  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.585  -6.535  -2.474  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.645  -8.579  -1.879  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -0.952  -7.175  -3.959  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.627  -8.849  -3.515  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -1.383  -8.075  -6.149  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -2.922  -8.916  -6.387  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.147  -7.715   0.236  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.221  -7.945   1.352  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.611  -6.727   1.771  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.366  -6.831   2.738  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.065  -7.339   0.426  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.768  -8.314   2.217  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.482  -8.732   1.078  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.495  -5.586   1.073  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.252  -4.361   1.350  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.339  -3.128   1.347  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.842  -3.191   0.999  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.461  -4.246   0.384  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.103  -4.163  -1.113  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.288  -4.303  -2.089  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.226  -3.097  -2.240  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       5.161  -2.943  -1.112  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.154  -5.557   0.286  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.657  -4.454   2.356  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       3.048  -3.368   0.655  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       3.094  -5.123   0.536  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.445  -4.997  -1.342  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.565  -3.236  -1.317  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.873  -5.188  -1.830  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       2.860  -4.481  -3.077  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.821  -3.251  -3.140  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       3.644  -2.184  -2.366  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       5.658  -3.811  -0.965  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       5.826  -2.213  -1.327  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       4.650  -2.695  -0.277  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.904  -1.987   1.742  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.276  -0.681   1.579  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.870  -0.022   0.324  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.085  -0.048   0.127  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.481   0.165   2.845  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.279  -0.268   4.066  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.241  -0.911   5.133  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.683  -0.030   4.394  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.740  -1.090   6.089  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.947  -0.562   5.687  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.750   0.622   3.745  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.208  -0.476   6.297  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -4.014   0.741   4.353  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.247   0.185   5.622  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.883  -1.999   1.980  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.797  -0.802   1.434  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.547   0.218   3.080  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.146   1.177   2.632  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.276  -1.217   5.226  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.575  -1.517   6.989  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.574   1.047   2.772  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.375  -0.904   7.274  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.812   1.257   3.837  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.225   0.267   6.079  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.024   0.578  -0.517  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.399   1.387  -1.689  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.014   2.843  -1.489  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.007   3.115  -0.818  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.253   0.848  -2.974  1.00  0.00           C  
+ATOM    163  OG1 THR A  10      -1.605   0.491  -2.768  1.00  0.00           O  
+ATOM    164  CG2 THR A  10       0.488  -0.376  -3.504  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.976   0.472  -0.350  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.481   1.367  -1.816  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -0.214   1.622  -3.742  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -1.920   0.078  -3.577  1.00  0.00           H  
+ATOM    169 HG21 THR A  10       0.474  -1.173  -2.760  1.00  0.00           H  
+ATOM    170 HG22 THR A  10       0.014  -0.727  -4.421  1.00  0.00           H  
+ATOM    171 HG23 THR A  10       1.522  -0.107  -3.725  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.739   3.790  -2.062  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.451   5.227  -1.990  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.348   5.614  -3.234  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.222   5.884  -4.292  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.752   6.026  -1.828  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.587   7.509  -1.681  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.565   8.418  -2.682  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.404   8.277  -0.456  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.455   9.693  -2.154  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.354   9.664  -0.779  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.255   7.928   0.897  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       1.206  10.658   0.204  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       1.067   8.906   1.887  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       1.056  10.271   1.549  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.510   3.511  -2.649  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.165   5.433  -1.113  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.258   5.660  -0.932  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.423   5.829  -2.664  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.636   8.170  -3.734  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.444  10.531  -2.718  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.278   6.885   1.156  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       1.199  11.703  -0.070  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.927   8.590   2.908  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.919  11.018   2.318  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.680   5.593  -3.105  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.612   5.674  -4.237  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.616   6.836  -4.141  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -4.447   7.017  -5.022  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.302   4.304  -4.372  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.681   3.958  -5.822  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -4.861   2.978  -5.847  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -5.447   2.807  -7.252  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -4.604   1.967  -8.118  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.058   5.359  -2.189  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.039   5.849  -5.150  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -2.640   3.514  -4.011  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.188   4.306  -3.735  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -3.964   4.862  -6.360  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -2.819   3.514  -6.323  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -4.551   2.010  -5.451  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.655   3.373  -5.214  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.425   2.335  -7.157  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.577   3.787  -7.711  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -4.356   1.119  -7.626  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -5.120   1.727  -8.953  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -3.766   2.469  -8.373  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.554   7.655  -3.099  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.890   7.482  -2.360  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -4.193   8.432  -3.080  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       11                                                                  
+ATOM      1  N   SER A   1      -3.110   9.167   0.007  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.762   8.075   0.749  1.00  0.00           C  
+ATOM      3  C   SER A   1      -3.032   6.748   0.566  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.698   6.347  -0.548  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -5.245   7.962   0.380  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.510   7.963  -1.015  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.711   8.322   1.810  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.659   7.057   0.825  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.766   8.814   0.821  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -4.713   7.801  -1.571  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.109   9.104   0.127  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -3.439  10.055   0.361  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.343   9.088  -0.973  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.762   6.059   1.680  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.256   4.688   1.657  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.400   3.691   1.409  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.505   3.855   1.924  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.521   4.382   2.969  1.00  0.00           C  
+ATOM     19  CG  TRP A   2      -0.184   5.046   3.145  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.071   6.121   3.927  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.112   4.633   2.604  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.416   6.426   3.874  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.120   5.488   3.146  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.546   3.587   1.758  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.487   5.296   2.891  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.916   3.384   1.492  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.886   4.232   2.062  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -3.076   6.420   2.569  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.554   4.601   0.832  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -2.162   4.648   3.811  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.349   3.306   3.020  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.669   6.651   4.516  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       1.824   7.239   4.316  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.812   2.919   1.339  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.221   5.954   3.333  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.232   2.558   0.869  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.935   4.062   1.862  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.161   2.649   0.609  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.167   1.642   0.232  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.558   0.235   0.230  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.420   0.035  -0.204  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.800   2.070  -1.100  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.659   3.152  -0.803  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.635   1.014  -1.824  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.257   2.609   0.141  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -4.962   1.629   0.980  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.016   2.414  -1.776  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -5.390   3.518   0.052  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -4.983   0.243  -2.235  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.363   0.566  -1.147  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.167   1.488  -2.650  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.276  -0.695   0.876  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.894  -2.093   1.066  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.064  -2.941  -0.199  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.173  -3.129  -0.705  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.707  -2.677   2.237  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.503  -4.134   2.555  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.342  -5.139   2.213  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.410  -4.769   3.289  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.861  -6.339   2.702  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.663  -6.169   3.362  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.218  -4.305   3.881  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.782  -7.063   3.990  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.322  -5.187   4.511  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.604  -6.563   4.571  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.170  -0.424   1.254  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.838  -2.104   1.304  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.474  -2.106   3.136  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.768  -2.530   2.026  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.261  -5.011   1.652  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.340  -7.221   2.595  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.978  -3.256   3.803  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.004  -8.119   4.026  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.396  -4.812   4.923  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.902  -7.232   5.050  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -2.958  -3.522  -0.669  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -2.935  -4.373  -1.846  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.086  -5.619  -1.561  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -0.916  -5.489  -1.208  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.385  -3.606  -3.064  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.433  -2.702  -3.737  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.856  -1.849  -4.875  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -1.829  -2.257  -5.461  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -3.465  -0.791  -5.147  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.093  -3.412  -0.142  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -3.965  -4.648  -2.052  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -1.528  -3.004  -2.757  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -2.046  -4.334  -3.804  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -4.230  -3.326  -4.143  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.869  -2.035  -2.992  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.663  -6.817  -1.726  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -1.998  -8.129  -1.719  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -0.854  -8.281  -0.692  1.00  0.00           C  
+ATOM     94  O   ASN A   6       0.267  -8.658  -1.034  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.588  -8.468  -3.166  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.784  -8.690  -4.086  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -3.930  -8.422  -3.754  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -2.554  -9.205  -5.275  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.618  -6.838  -2.058  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.744  -8.870  -1.425  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -0.972  -7.662  -3.566  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.997  -9.384  -3.163  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -1.630  -9.437  -5.592  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -3.380  -9.344  -5.831  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.164  -8.017   0.584  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.226  -8.148   1.702  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.576  -6.880   2.020  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.365  -6.903   2.962  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.097  -7.689   0.782  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.768  -8.447   2.599  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.489  -8.941   1.479  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.405  -5.798   1.245  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.229  -4.582   1.269  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.376  -3.312   1.356  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.852  -3.339   1.293  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.122  -4.507   0.009  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.677  -5.848  -0.485  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.596  -5.624  -1.689  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.106  -6.952  -2.253  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       3.043  -7.682  -2.965  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.247  -5.866   0.464  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.876  -4.602   2.148  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       1.545  -4.064  -0.806  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       2.961  -3.843   0.224  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.231  -6.336   0.317  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.850  -6.488  -0.796  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.057  -5.088  -2.472  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.450  -5.022  -1.378  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.914  -6.739  -2.950  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.495  -7.570  -1.442  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       2.517  -8.245  -2.311  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       2.423  -7.019  -3.408  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.458  -8.277  -3.669  1.00  0.00           H  
+ATOM    134  N   TRP A   9       1.063  -2.174   1.412  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.500  -0.831   1.379  1.00  0.00           C  
+ATOM    136  C   TRP A   9       1.164  -0.049   0.246  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.384  -0.109   0.098  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.757  -0.146   2.727  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.090  -0.600   3.872  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.332  -1.328   4.931  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.465  -0.218   4.166  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.681  -1.397   5.869  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.771  -0.640   5.489  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.447   0.528   3.481  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.958  -0.265   6.135  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.643   0.906   4.113  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.892   0.526   5.443  1.00  0.00           C  
+ATOM    148  H   TRP A   9       2.069  -2.231   1.363  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.575  -0.871   1.204  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.809  -0.237   3.008  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.564   0.919   2.606  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.329  -1.735   5.044  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.593  -1.879   6.751  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.269   0.846   2.468  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.140  -0.567   7.155  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.361   1.516   3.582  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.804   0.842   5.927  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.380   0.710  -0.526  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.888   1.617  -1.570  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.229   2.996  -1.489  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.832   3.151  -0.883  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.771   0.962  -2.958  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       1.276   1.838  -3.938  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -0.648   0.554  -3.358  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.630   0.667  -0.386  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.952   1.799  -1.405  1.00  0.00           H  
+ATOM    167  HB  THR A  10       1.394   0.067  -2.961  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       1.222   1.390  -4.786  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.325   1.408  -3.305  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -0.643   0.165  -4.375  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.005  -0.237  -2.697  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.905   4.016  -2.028  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.532   5.427  -1.936  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.231   5.836  -3.201  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.364   6.018  -4.264  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.773   6.301  -1.671  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.455   7.761  -1.590  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.531   8.643  -2.611  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.896   8.501  -0.467  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.033   9.867  -2.205  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.576   9.821  -0.904  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.586   8.168   0.867  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11      -0.065  10.751  -0.070  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11      -0.055   9.089   1.713  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11      -0.381  10.375   1.249  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.688   3.769  -2.621  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.136   5.563  -1.084  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.223   5.991  -0.726  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.522   6.144  -2.445  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.881   8.396  -3.606  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.986  10.676  -2.809  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.846   7.186   1.228  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11      -0.310  11.737  -0.438  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11      -0.302   8.800   2.723  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11      -0.870  11.066   1.919  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.560   5.953  -3.083  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.506   6.147  -4.186  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -3.229   7.488  -4.034  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.727   7.831  -2.961  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.488   4.957  -4.222  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.439   5.034  -5.430  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.391   3.834  -5.555  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.576   3.942  -4.592  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.594   2.921  -4.887  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.965   5.878  -2.149  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.949   6.158  -5.126  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -2.913   4.031  -4.291  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.067   4.936  -3.298  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.039   5.942  -5.370  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.840   5.084  -6.340  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.778   3.814  -6.575  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -4.851   2.903  -5.374  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.222   3.821  -3.567  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -7.032   4.927  -4.695  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -8.274   2.889  -4.140  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -8.060   3.153  -5.752  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.149   2.019  -4.979  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -3.311   8.247  -5.120  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.897   7.939  -5.987  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -3.791   9.129  -5.050  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       12                                                                  
+ATOM      1  N   SER A   1      -2.529   9.150   2.079  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.338   8.295   1.193  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.635   6.966   0.948  1.00  0.00           C  
+ATOM      4  O   SER A   1      -1.985   6.782  -0.081  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -3.631   8.980  -0.143  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.537  10.040   0.060  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -4.290   8.094   1.684  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -2.704   9.351  -0.586  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.087   8.257  -0.820  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.137  10.061  -0.692  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -1.625   9.309   1.659  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.405   8.689   2.970  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.998  10.033   2.220  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.793   6.028   1.887  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.295   4.658   1.772  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.473   3.684   1.691  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.487   3.863   2.363  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.386   4.322   2.959  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.007   4.887   2.980  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.425   5.903   3.773  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.222   4.323   2.388  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.801   6.023   3.690  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.348   5.029   2.905  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.497   3.225   1.544  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.670   4.659   2.614  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.819   2.816   1.273  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.906   3.532   1.807  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -3.414   6.210   2.662  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.716   4.560   0.854  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.894   4.608   3.881  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.272   3.239   2.992  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.212   6.504   4.408  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.341   6.700   4.208  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.668   2.666   1.150  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.498   5.218   3.026  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.007   1.933   0.678  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.918   3.209   1.607  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.338   2.680   0.824  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.376   1.704   0.453  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.804   0.293   0.473  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.644   0.098   0.112  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.940   2.023  -0.940  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -3.920   2.153  -1.910  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.743   3.323  -0.907  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.466   2.641   0.304  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.206   1.734   1.164  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.601   1.211  -1.245  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -3.088   1.834  -1.540  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -5.083   4.170  -0.721  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.243   3.465  -1.864  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.491   3.272  -0.115  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.595  -0.674   0.948  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.163  -2.057   1.148  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.446  -2.947  -0.073  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.599  -3.123  -0.470  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.830  -2.607   2.412  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.573  -4.062   2.627  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.303  -5.075   2.108  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.470  -4.683   3.344  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.738  -6.281   2.471  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.621  -6.096   3.259  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.359  -4.187   4.056  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.732  -6.982   3.883  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.447  -5.066   4.665  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.636  -6.458   4.589  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.544  -0.449   1.210  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.087  -2.073   1.321  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.444  -2.052   3.280  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.910  -2.448   2.361  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.178  -4.940   1.482  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.105  -7.177   2.185  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.218  -3.118   4.134  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.881  -8.047   3.808  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.601  -4.668   5.208  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.929  -7.122   5.064  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.398  -3.576  -0.623  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.509  -4.454  -1.787  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.513  -5.628  -1.709  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.355  -5.451  -1.338  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -3.312  -3.623  -3.067  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.832  -4.348  -4.317  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -3.880  -3.405  -5.520  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -4.883  -2.665  -5.623  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -2.915  -3.435  -6.314  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.467  -3.452  -0.220  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.530  -4.836  -1.799  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.868  -2.689  -2.966  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -2.255  -3.380  -3.194  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -3.189  -5.199  -4.543  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -4.839  -4.721  -4.125  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.967  -6.837  -2.069  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.182  -8.072  -2.231  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.159  -8.424  -1.114  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.208  -9.164  -1.368  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.626  -8.138  -3.672  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -0.376  -7.309  -3.953  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -0.406  -6.317  -4.660  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6       0.772  -7.747  -3.479  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.929  -6.883  -2.369  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.911  -8.882  -2.173  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -1.391  -9.176  -3.906  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -2.401  -7.820  -4.370  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6       0.747  -8.506  -2.798  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6       1.594  -7.244  -3.749  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.364  -7.932   0.115  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.488  -8.114   1.282  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.394  -6.918   1.672  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.053  -7.004   2.709  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.153  -7.311   0.218  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.107  -8.357   2.144  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.177  -8.968   1.131  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.385  -5.797   0.930  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.107  -4.575   1.321  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.242  -3.315   1.236  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.862  -3.315   0.688  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.431  -4.441   0.538  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.288  -4.308  -0.992  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.654  -4.229  -1.699  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.516  -5.487  -1.517  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       4.064  -6.599  -2.368  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.199  -5.754   0.091  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.388  -4.687   2.366  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.974  -3.568   0.905  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       3.037  -5.315   0.772  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.726  -5.154  -1.388  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.735  -3.394  -1.217  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.496  -4.062  -2.766  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.205  -3.372  -1.309  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.549  -5.250  -1.775  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.490  -5.801  -0.474  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       3.102  -6.819  -2.154  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.145  -6.329  -3.338  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       4.643  -7.409  -2.197  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.781  -2.216   1.765  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.234  -0.880   1.560  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.858  -0.273   0.298  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.041  -0.474   0.023  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.540   0.021   2.763  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.168  -0.265   4.049  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.362  -0.870   5.136  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.510   0.155   4.437  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.537  -0.799   6.185  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.710  -0.177   5.810  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.564   0.822   3.777  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.891   0.150   6.496  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.745   1.166   4.454  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.913   0.832   5.810  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.713  -2.284   2.140  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.846  -0.939   1.434  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.617   0.060   2.941  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.229   1.027   2.497  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.369  -1.262   5.196  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.320  -1.091   7.127  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.466   1.090   2.742  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.004  -0.098   7.540  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.528   1.682   3.920  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.824   1.107   6.322  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.083   0.540  -0.421  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.547   1.357  -1.547  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.038   2.770  -1.462  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.184   2.943  -1.035  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.235   0.654  -2.878  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.828   1.378  -3.925  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.252   0.500  -3.203  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.904   0.591  -0.171  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.633   1.447  -1.488  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.681  -0.340  -2.850  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.413   1.097  -4.745  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.369  -0.131  -4.085  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.769   0.019  -2.374  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.699   1.476  -3.397  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.780   3.780  -1.781  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.415   5.200  -1.789  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.443   5.554  -3.012  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.131   5.118  -4.120  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.695   6.049  -1.808  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.463   7.524  -1.709  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.470   8.421  -2.722  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.160   8.282  -0.507  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.201   9.683  -2.219  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.003   9.654  -0.853  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.997   7.927   0.843  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.712  10.637   0.108  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.697   8.897   1.813  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.562  10.251   1.452  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.699   3.544  -2.123  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.136   5.428  -0.878  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.319   5.755  -0.962  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.265   5.845  -2.714  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.663   8.176  -3.759  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.177  10.522  -2.783  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.106   6.891   1.119  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.609  11.673  -0.182  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.573   8.579   2.833  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.341  10.991   2.209  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.462   6.413  -2.842  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.344   6.860  -3.936  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.665   8.358  -3.871  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.724   8.783  -3.424  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.602   5.969  -4.016  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.242   4.615  -4.650  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -4.460   3.783  -5.061  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -3.950   2.450  -5.617  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -5.003   1.424  -5.634  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.663   6.708  -1.887  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.811   6.731  -4.878  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.023   5.816  -3.020  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.351   6.457  -4.642  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -2.638   4.787  -5.543  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -2.653   4.037  -3.937  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.089   3.608  -4.189  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.033   4.307  -5.829  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -3.568   2.600  -6.629  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -3.135   2.097  -4.986  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -5.704   1.664  -6.320  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -4.594   0.528  -5.865  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -5.427   1.372  -4.719  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -1.740   9.180  -4.353  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -0.863   8.813  -4.685  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -1.958  10.162  -4.400  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       13                                                                  
+ATOM      1  N   SER A   1      -3.319   9.394  -0.106  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.041   8.670   1.149  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.606   7.213   0.891  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.189   6.862  -0.216  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.251   8.765   2.086  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -3.815   8.598   3.420  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.215   9.186   1.637  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.721   9.746   1.989  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.984   7.996   1.838  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -3.910   9.440   3.881  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.456   9.545  -0.609  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -3.740  10.288   0.108  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.951   8.856  -0.681  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.646   6.357   1.921  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.276   4.941   1.827  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.477   3.994   1.658  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.500   4.146   2.320  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.464   4.551   3.070  1.00  0.00           C  
+ATOM     19  CG  TRP A   2      -0.087   5.137   3.194  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.264   6.186   3.974  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.159   4.618   2.635  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.637   6.353   3.937  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.244   5.367   3.182  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.484   3.554   1.762  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.585   5.056   2.901  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.825   3.258   1.441  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.873   3.999   2.020  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.988   6.723   2.804  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.672   4.825   0.931  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -2.037   4.819   3.960  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.348   3.466   3.107  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.422   6.792   4.552  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.118   7.111   4.402  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.685   2.955   1.358  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.383   5.629   3.351  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.054   2.438   0.773  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.898   3.748   1.786  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.315   2.969   0.808  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.322   1.955   0.428  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.728   0.543   0.604  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.537   0.345   0.354  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.754   2.165  -1.043  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -4.794   3.538  -1.357  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -6.160   1.655  -1.359  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.409   2.875   0.350  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.198   2.058   1.070  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.037   1.676  -1.705  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.496   4.005  -0.572  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.381   1.850  -2.409  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.235   0.584  -1.179  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.894   2.188  -0.752  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.531  -0.441   1.038  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.104  -1.843   1.188  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.289  -2.612  -0.126  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.355  -2.569  -0.748  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.855  -2.523   2.339  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.598  -3.999   2.481  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.344  -4.978   1.920  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.509  -4.686   3.173  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.833  -6.214   2.269  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.694  -6.094   3.037  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.379  -4.262   3.903  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.805  -7.032   3.586  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.459  -5.188   4.428  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.665  -6.569   4.267  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.520  -0.258   1.120  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.043  -1.866   1.436  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.565  -2.034   3.272  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.927  -2.368   2.209  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.218  -4.803   1.304  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.251  -7.088   1.987  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.219  -3.206   4.032  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.966  -8.090   3.447  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.583  -4.832   4.954  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.933  -7.267   4.653  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.243  -3.324  -0.554  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.180  -3.894  -1.889  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.310  -5.170  -1.889  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.102  -5.069  -1.696  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.623  -2.793  -2.821  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.142  -2.860  -4.261  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.854  -4.201  -4.929  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -1.692  -4.393  -5.349  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -3.799  -5.017  -4.995  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.404  -3.384   0.025  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.204  -4.111  -2.186  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.930  -1.819  -2.438  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.534  -2.809  -2.821  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -4.217  -2.672  -4.259  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.668  -2.062  -4.835  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.899  -6.365  -2.079  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.204  -7.661  -2.227  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -0.965  -7.820  -1.305  1.00  0.00           C  
+ATOM     94  O   ASN A   6       0.187  -7.891  -1.744  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.962  -7.912  -3.734  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.355  -9.268  -4.094  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.032 -10.172  -4.554  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.062  -9.440  -3.921  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.898  -6.372  -2.204  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.900  -8.437  -1.904  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.924  -7.857  -4.244  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.328  -7.126  -4.140  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6       0.425  -8.757  -3.339  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6       0.316 -10.337  -4.166  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.236  -7.981  -0.004  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.252  -8.296   1.033  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.544  -7.122   1.603  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.277  -7.323   2.571  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.201  -7.911   0.278  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.771  -8.772   1.865  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.479  -8.984   0.621  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.374  -5.907   1.068  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.122  -4.719   1.489  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.265  -3.453   1.433  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.895  -3.471   1.018  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.394  -4.604   0.623  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.083  -4.270  -0.846  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.350  -4.320  -1.703  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       3.042  -4.167  -3.195  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       2.294  -5.321  -3.728  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.251  -5.802   0.275  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.429  -4.851   2.529  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       3.055  -3.839   1.032  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       2.928  -5.556   0.663  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.373  -4.998  -1.230  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.645  -3.272  -0.917  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.017  -3.514  -1.396  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       3.860  -5.272  -1.546  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       2.469  -3.255  -3.361  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       3.989  -4.090  -3.731  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       2.375  -5.340  -4.734  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       2.674  -6.174  -3.343  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       1.321  -5.243  -3.468  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.874  -2.333   1.821  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.326  -0.993   1.642  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.995  -0.303   0.451  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.213  -0.383   0.297  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.549  -0.173   2.915  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.230  -0.608   4.114  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.202  -1.452   5.080  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.548  -0.148   4.536  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.720  -1.477   6.107  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.773  -0.620   5.861  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.543   0.674   3.962  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.876  -0.209   6.623  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.670   1.068   4.705  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.824   0.650   6.039  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.835  -2.400   2.114  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.747  -1.052   1.456  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.611  -0.148   3.176  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.260   0.857   2.707  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.151  -1.972   5.071  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.599  -2.013   6.956  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.438   1.037   2.953  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.995  -0.553   7.640  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.406   1.718   4.254  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.680   0.980   6.610  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.208   0.439  -0.333  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.666   1.300  -1.438  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.123   2.723  -1.277  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.970   2.939  -0.748  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.290   0.682  -2.795  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.921   1.405  -3.828  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.210   0.633  -3.088  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.792   0.442  -0.127  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.755   1.372  -1.429  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.676  -0.340  -2.815  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.381   2.170  -4.054  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.615   1.637  -3.217  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.379   0.056  -3.999  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.729   0.142  -2.266  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.917   3.714  -1.692  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.513   5.121  -1.720  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.327   5.413  -2.973  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.069   4.854  -4.042  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.760   6.011  -1.660  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.481   7.481  -1.704  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.377   8.237  -2.821  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.229   8.380  -0.588  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.072   9.538  -2.468  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.996   9.691  -1.098  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.174   8.212   0.810  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.756  10.792  -0.260  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.910   9.298   1.658  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.722  10.589   1.133  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.797   3.469  -2.123  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.086   5.348  -0.837  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.282   5.795  -0.726  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.441   5.764  -2.473  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.490   7.862  -3.830  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.895  10.273  -3.137  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.344   7.232   1.226  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.603  11.774  -0.682  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.867   9.124   2.719  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.555  11.413   1.810  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.295   6.331  -2.848  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.222   6.743  -3.908  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.358   8.272  -3.921  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -2.254   8.934  -2.893  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.558   6.007  -3.661  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.357   5.694  -4.939  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.360   4.542  -4.729  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -4.712   3.159  -4.545  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -3.952   2.735  -5.732  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.467   6.720  -1.920  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.811   6.429  -4.868  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.335   5.062  -3.169  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.181   6.588  -2.978  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.904   6.587  -5.240  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.676   5.426  -5.747  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.974   4.757  -3.852  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.023   4.491  -5.593  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -4.046   3.170  -3.682  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.501   2.429  -4.360  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -4.487   2.944  -6.563  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -3.075   3.234  -5.763  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -3.775   1.741  -5.686  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.588   8.869  -5.082  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.675   8.341  -5.935  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.627   9.876  -5.075  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       14                                                                  
+ATOM      1  N   SER A   1      -1.736   8.982   2.943  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -2.767   8.421   2.056  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.252   7.134   1.426  1.00  0.00           C  
+ATOM      4  O   SER A   1      -1.735   7.086   0.308  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -3.246   9.443   1.027  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.184   8.861   0.149  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.625   8.159   2.675  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -3.728  10.271   1.549  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -2.396   9.819   0.460  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -3.865   9.043  -0.775  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.060   9.846   3.354  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -0.896   9.153   2.408  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -1.529   8.319   3.676  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.410   6.070   2.207  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.040   4.699   1.902  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.304   3.852   1.801  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.204   4.003   2.625  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.158   4.186   3.052  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.208   4.789   3.115  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.635   5.767   3.949  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.368   4.393   2.332  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.985   5.989   3.741  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.496   5.136   2.782  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.576   3.438   1.318  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.782   4.925   2.261  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.858   3.218   0.782  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.960   3.954   1.258  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.879   6.201   3.090  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.492   4.652   0.961  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.668   4.348   4.004  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.027   3.105   2.966  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.026   6.276   4.686  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.525   6.671   4.254  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.730   2.862   0.979  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.619   5.501   2.626  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.000   2.477   0.009  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.943   3.768   0.849  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.373   2.956   0.813  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.403   1.908   0.771  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.771   0.530   0.551  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.599   0.407   0.182  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.551   2.246  -0.194  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -6.518   1.223  -0.115  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.132   2.425  -1.653  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.601   2.892   0.149  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -4.867   1.838   1.756  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -6.024   3.171   0.143  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -7.214   1.418  -0.748  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.015   2.439  -2.293  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -4.607   3.374  -1.769  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -4.478   1.610  -1.962  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.506  -0.504   0.962  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.039  -1.881   0.997  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.249  -2.585  -0.340  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.341  -2.564  -0.912  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.767  -2.634   2.116  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.527  -4.115   2.163  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.311  -5.043   1.572  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.460  -4.860   2.827  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.838  -6.307   1.865  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.725  -6.254   2.677  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.309  -4.503   3.560  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.934  -7.241   3.285  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.490  -5.484   4.151  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.813  -6.847   4.035  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.485  -0.313   1.138  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.970  -1.873   1.197  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.477  -2.205   3.077  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.841  -2.475   2.001  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.193  -4.813   0.986  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.298  -7.152   1.556  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.065  -3.456   3.667  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.183  -8.288   3.184  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.611  -5.187   4.706  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.190  -7.588   4.515  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.213  -3.290  -0.789  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.240  -4.102  -1.990  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.597  -5.465  -1.714  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.397  -5.508  -1.457  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.524  -3.376  -3.141  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.955  -4.035  -4.455  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.387  -3.314  -5.673  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -2.938  -2.242  -6.009  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -1.419  -3.851  -6.256  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.361  -3.312  -0.228  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.285  -4.225  -2.269  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.805  -2.322  -3.152  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.440  -3.444  -3.027  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.623  -5.076  -4.459  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -4.044  -4.028  -4.515  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.386  -6.554  -1.728  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.948  -7.962  -1.706  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.579  -8.185  -1.013  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.568  -8.449  -1.669  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -3.039  -8.517  -3.143  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.753 -10.011  -3.251  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -3.650 -10.836  -3.281  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -1.496 -10.391  -3.309  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.358  -6.399  -1.950  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.679  -8.516  -1.116  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -4.048  -8.357  -3.522  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -2.344  -7.975  -3.786  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.795  -9.697  -3.050  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -1.314 -11.377  -3.359  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.545  -8.059   0.321  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.342  -8.270   1.133  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.488  -7.015   1.459  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.381  -7.117   2.297  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.396  -7.807   0.801  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.628  -8.741   2.073  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.316  -8.969   0.615  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.236  -5.857   0.826  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.089  -4.654   0.907  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.264  -3.354   1.027  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.948  -3.346   0.823  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       1.988  -4.681  -0.353  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.144  -3.671  -0.431  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.244  -3.919   0.611  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.381  -2.912   0.422  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       5.015  -1.574   0.920  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.494  -5.846   0.112  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.716  -4.734   1.795  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.427  -5.677  -0.447  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.353  -4.530  -1.228  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.595  -3.752  -1.420  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       2.767  -2.657  -0.341  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.848  -3.836   1.625  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.643  -4.924   0.471  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       6.259  -3.261   0.965  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       5.626  -2.849  -0.639  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       4.214  -1.225   0.410  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.788  -1.636   1.902  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       5.793  -0.941   0.796  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.927  -2.231   1.329  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.371  -0.871   1.264  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.960  -0.101   0.070  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.178  -0.075  -0.092  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.650  -0.108   2.573  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.059  -0.607   3.796  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.500  -1.319   4.802  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.433  -0.341   4.214  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.445  -1.550   5.784  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.638  -0.919   5.500  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.500   0.404   3.671  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.844  -0.777   6.205  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.712   0.559   4.368  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.887  -0.031   5.630  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.919  -2.309   1.490  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.709  -0.923   1.133  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.726  -0.065   2.775  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.331   0.923   2.426  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.530  -1.650   4.829  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.262  -2.082   6.624  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.358   0.901   2.727  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.974  -1.237   7.174  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.509   1.152   3.942  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.821   0.100   6.158  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.102   0.588  -0.700  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.439   1.485  -1.834  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.049   2.916  -1.557  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.110   3.107  -0.954  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.145   0.936  -3.147  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.412   1.662  -4.217  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.671   1.003  -3.269  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.889   0.516  -0.466  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.520   1.524  -1.999  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.163  -0.106  -3.246  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -0.146   2.425  -4.397  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -2.132   0.476  -2.435  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -2.018   2.037  -3.274  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.983   0.522  -4.198  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.733   3.933  -1.945  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.368   5.348  -1.771  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.642   5.793  -2.836  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.588   5.343  -3.983  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.627   6.234  -1.807  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.418   7.719  -1.678  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.416   8.616  -2.693  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.269   8.506  -0.459  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.261   9.894  -2.186  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.203   9.887  -0.807  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       1.232   8.187   0.913  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       1.137  10.904   0.160  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       1.194   9.195   1.893  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       1.155  10.551   1.522  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.576   3.726  -2.462  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.098   5.468  -0.794  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.274   5.925  -0.986  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.174   6.050  -2.730  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.550   8.367  -3.739  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.268  10.731  -2.752  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.266   7.147   1.198  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       1.102  11.942  -0.140  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       1.205   8.917   2.934  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       1.155  11.318   2.285  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.521   6.728  -2.460  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.590   7.283  -3.292  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.655   8.803  -3.110  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.244   9.306  -2.155  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.908   6.574  -2.941  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -5.014   6.916  -3.947  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -6.348   6.276  -3.549  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -7.372   6.572  -4.647  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -8.718   6.100  -4.282  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.506   7.005  -1.478  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.365   7.073  -4.340  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.747   5.495  -2.964  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.223   6.851  -1.933  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.147   7.998  -4.003  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -4.721   6.547  -4.931  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -6.228   5.196  -3.449  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.687   6.691  -2.598  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.408   7.647  -4.825  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -7.056   6.072  -5.563  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -9.082   6.672  -3.534  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -9.325   6.173  -5.086  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -8.670   5.138  -3.982  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.027   9.550  -4.008  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.548   9.120  -4.781  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.037  10.550  -3.879  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       15                                                                  
+ATOM      1  N   SER A   1      -2.373   8.824  -0.476  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -2.855   8.133   0.735  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.612   6.621   0.658  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.575   6.019  -0.419  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.312   8.509   1.026  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.174   8.151  -0.035  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.259   8.502   1.568  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.643   8.030   1.948  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.367   9.592   1.161  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -6.040   8.540   0.129  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.375   9.821  -0.314  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.982   8.609  -1.253  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -1.433   8.520  -0.687  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.259   6.009   1.791  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.007   4.573   1.855  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.264   3.709   1.715  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.230   3.874   2.446  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.228   4.246   3.131  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.158   4.811   3.131  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.609   5.833   3.897  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.297   4.373   2.331  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.939   6.076   3.600  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.411   5.205   2.638  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.506   3.331   1.402  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.656   5.054   2.010  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.764   3.135   0.799  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.831   4.008   1.084  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.179   6.543   2.643  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.408   4.334   0.986  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.778   4.614   3.998  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.148   3.161   3.227  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.019   6.381   4.618  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.491   6.793   4.047  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.688   2.662   1.190  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.466   5.730   2.236  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.923   2.304   0.128  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.789   3.865   0.604  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.211   2.769   0.763  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.254   1.790   0.427  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.681   0.370   0.524  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.538   0.129   0.130  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.792   2.075  -0.985  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.222   3.416  -1.056  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.990   1.199  -1.351  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.360   2.709   0.210  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.090   1.879   1.128  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -3.994   1.919  -1.712  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.590   3.948  -0.566  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.431   1.559  -2.281  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -5.674   0.165  -1.490  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.742   1.252  -0.562  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.462  -0.555   1.092  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.116  -1.968   1.270  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.420  -2.802   0.016  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.556  -2.863  -0.462  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.853  -2.528   2.499  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.757  -4.015   2.685  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.690  -4.909   2.288  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.689  -4.805   3.295  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -5.258  -6.190   2.567  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -4.031  -6.183   3.191  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.469  -4.499   3.933  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -3.197  -7.203   3.670  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.642  -5.509   4.456  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -2.001  -6.859   4.319  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.388  -0.278   1.383  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.044  -2.040   1.453  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.457  -2.047   3.392  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.910  -2.265   2.426  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.625  -4.644   1.807  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.790  -7.019   2.344  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.173  -3.461   4.016  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.484  -8.240   3.557  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.717  -5.249   4.952  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.352  -7.631   4.713  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.402  -3.506  -0.481  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.483  -4.284  -1.703  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.604  -5.532  -1.556  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.509  -5.421  -1.014  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.964  -3.410  -2.860  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.207  -3.987  -4.259  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.769  -2.997  -5.341  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -3.485  -1.987  -5.517  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -1.719  -3.262  -5.967  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.506  -3.506   0.009  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.538  -4.502  -1.856  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.444  -2.434  -2.809  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.890  -3.270  -2.736  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.626  -4.897  -4.362  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -4.262  -4.231  -4.393  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.025  -6.694  -2.069  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.204  -7.906  -2.249  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.276  -8.355  -1.079  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.338  -9.109  -1.327  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.447  -7.742  -3.589  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.362  -7.463  -4.780  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -3.564  -7.682  -4.749  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -1.833  -6.928  -5.863  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.896  -6.699  -2.582  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -2.894  -8.739  -2.384  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -0.737  -6.920  -3.489  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.891  -8.652  -3.807  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.862  -6.681  -5.933  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -2.503  -6.728  -6.586  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.516  -7.935   0.173  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.675  -8.237   1.348  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.262  -7.101   1.790  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.079  -7.313   2.684  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.246  -7.245   0.274  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.313  -8.498   2.192  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7      -0.054  -9.117   1.167  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.182  -5.923   1.157  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.024  -4.749   1.410  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.185  -3.465   1.419  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -1.030  -3.458   1.209  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.143  -4.673   0.336  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.538  -4.340   0.908  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.559  -4.044  -0.206  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.980  -3.894   0.357  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       6.962  -3.535  -0.685  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.526  -5.816   0.432  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.474  -4.854   2.401  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.216  -5.627  -0.186  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.873  -3.920  -0.409  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.476  -3.470   1.563  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.883  -5.192   1.495  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.553  -4.857  -0.933  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.276  -3.117  -0.711  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.982  -3.115   1.120  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       6.283  -4.835   0.814  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       7.875  -3.427  -0.265  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       7.004  -4.264  -1.383  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       6.695  -2.666  -1.123  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.887  -2.355   1.615  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.395  -0.996   1.465  1.00  0.00           C  
+ATOM    136  C   TRP A   9       1.015  -0.352   0.213  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.194  -0.555  -0.074  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.757  -0.220   2.739  1.00  0.00           C  
+ATOM    139  CG  TRP A   9       0.022  -0.642   3.977  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.527  -1.375   4.998  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.351  -0.324   4.354  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.414  -1.467   6.008  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.582  -0.815   5.674  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.416   0.350   3.725  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.791  -0.599   6.353  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.639   0.561   4.389  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.823   0.098   5.702  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.878  -2.462   1.759  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.690  -1.001   1.355  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.833  -0.283   2.925  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.529   0.831   2.579  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.529  -1.782   5.036  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.245  -1.922   6.891  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.301   0.713   2.719  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.927  -0.963   7.360  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.435   1.083   3.878  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.765   0.271   6.203  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.233   0.470  -0.494  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.654   1.309  -1.631  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.066   2.718  -1.495  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.978   2.908  -0.869  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.284   0.655  -2.978  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.521   1.565  -4.027  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.168   0.186  -3.099  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.751   0.532  -0.229  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.741   1.408  -1.620  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.933  -0.207  -3.129  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.125   1.210  -4.827  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.403  -0.514  -2.297  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.849   1.035  -3.046  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.305  -0.335  -4.046  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.774   3.738  -1.989  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.268   5.107  -2.059  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.684   5.256  -3.260  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.244   5.510  -4.379  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.455   6.082  -2.063  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.117   7.535  -1.947  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       0.948   8.402  -2.970  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.952   8.317  -0.729  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.713   9.670  -2.466  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.738   9.680  -1.086  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.973   8.002   0.645  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.578  10.690  -0.123  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.791   8.999   1.619  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.604  10.342   1.240  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.640   3.533  -2.464  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.310   5.303  -1.155  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.087   5.838  -1.207  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.068   5.929  -2.950  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.006   8.132  -4.017  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.556  10.480  -3.050  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       1.149   6.979   0.938  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.430  11.717  -0.425  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.816   8.726   2.663  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.481  11.104   1.997  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.993   5.065  -3.022  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -3.065   5.060  -4.042  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -4.262   5.974  -3.704  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -5.173   6.138  -4.505  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.484   3.600  -4.322  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.164   3.388  -5.687  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -4.476   1.901  -5.917  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -5.114   1.674  -7.290  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -5.319   0.239  -7.555  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.238   4.859  -2.057  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.647   5.459  -4.967  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -2.592   2.973  -4.299  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.158   3.261  -3.536  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -5.096   3.950  -5.734  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.498   3.742  -6.474  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -3.549   1.329  -5.857  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.161   1.552  -5.143  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.075   2.186  -7.334  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -4.461   2.084  -8.060  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -4.443  -0.253  -7.447  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -5.993  -0.134  -6.901  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -5.660   0.112  -8.497  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -4.272   6.628  -2.551  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -3.529   6.491  -1.879  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -5.050   7.231  -2.336  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       16                                                                  
+ATOM      1  N   SER A   1      -2.424   8.952  -0.072  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.089   8.094   0.925  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.622   6.649   0.793  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.506   6.110  -0.311  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.615   8.194   0.840  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.098   7.751  -0.412  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.789   8.445   1.913  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.059   7.588   1.632  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -4.913   9.233   0.988  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.749   7.055  -0.274  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -1.430   8.773  -0.049  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.589   9.922   0.151  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.780   8.745  -0.994  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.298   6.028   1.932  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -1.962   4.608   2.001  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.216   3.728   1.923  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.128   3.862   2.729  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.134   4.315   3.263  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.276   4.829   3.215  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.792   5.815   3.980  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.384   4.356   2.385  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       2.124   5.998   3.670  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.559   5.066   2.749  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.514   3.389   1.366  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.818   4.773   2.196  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.766   3.080   0.809  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.920   3.756   1.233  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.394   6.524   2.805  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.367   4.385   1.120  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.636   4.710   4.149  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.079   3.235   3.398  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.237   6.378   4.721  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.700   6.727   4.070  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.630   2.875   1.030  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.695   5.316   2.515  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       2.849   2.315   0.047  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.882   3.505   0.804  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.235   2.816   0.942  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.345   1.902   0.610  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.800   0.474   0.471  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.616   0.298   0.186  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -5.044   2.383  -0.679  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.224   3.782  -0.633  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -6.429   1.765  -0.869  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.435   2.788   0.312  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.076   1.906   1.421  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.417   2.145  -1.539  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.361   4.166  -0.446  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.988   1.797   0.068  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.977   2.335  -1.620  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.340   0.735  -1.214  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.596  -0.555   0.767  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.117  -1.936   0.881  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.434  -2.790  -0.351  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.579  -2.888  -0.786  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.695  -2.555   2.155  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.465  -4.025   2.324  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.293  -4.999   1.884  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.357  -4.706   2.983  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.789  -6.233   2.247  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.604  -6.108   2.939  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.170  -4.281   3.612  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.741  -7.035   3.538  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.305  -5.197   4.238  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.596  -6.572   4.211  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.569  -0.384   0.970  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -3.032  -1.927   0.981  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.254  -2.037   3.009  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.771  -2.373   2.178  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.218  -4.819   1.347  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.276  -7.103   2.083  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.938  -3.232   3.616  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.969  -8.089   3.513  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.413  -4.855   4.747  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.936  -7.268   4.709  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.394  -3.432  -0.887  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.437  -4.222  -2.107  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.730  -5.568  -1.851  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.505  -5.616  -1.717  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.781  -3.353  -3.191  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.960  -3.840  -4.633  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -1.606  -3.957  -5.334  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -0.960  -5.012  -5.154  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -1.232  -2.983  -6.023  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.457  -3.239  -0.538  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.477  -4.398  -2.381  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.217  -2.355  -3.133  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.720  -3.255  -2.958  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -3.475  -4.800  -4.657  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.576  -3.114  -5.168  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.513  -6.650  -1.695  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -3.088  -8.044  -1.480  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.732  -8.230  -0.746  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.798  -8.798  -1.308  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -3.213  -8.832  -2.810  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.447  -8.295  -4.022  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.904  -8.415  -5.146  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -1.286  -7.699  -3.859  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.506  -6.505  -1.803  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.822  -8.493  -0.811  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.916  -9.868  -2.651  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -4.266  -8.843  -3.094  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.895  -7.589  -2.929  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -0.887  -7.271  -4.675  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.614  -7.763   0.507  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.400  -7.934   1.320  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.542  -6.720   1.413  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.497  -6.791   2.185  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.400  -7.284   0.923  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.672  -8.243   2.330  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.191  -8.760   0.920  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.328  -5.627   0.653  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.214  -4.440   0.634  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.408  -3.126   0.687  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.700  -3.038   0.148  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.104  -4.550  -0.629  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.216  -3.496  -0.814  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.602  -3.778  -0.200  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.648  -4.157   1.286  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       4.439  -5.600   1.506  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.440  -5.649  -0.018  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.853  -4.462   1.517  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.562  -5.540  -0.665  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.441  -4.478  -1.495  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.381  -3.396  -1.887  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       2.869  -2.526  -0.470  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       5.106  -4.551  -0.782  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       5.187  -2.864  -0.314  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.638  -3.904   1.668  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       3.905  -3.582   1.837  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       5.145  -6.121   1.006  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.512  -5.805   2.492  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.523  -5.871   1.176  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.967  -2.084   1.323  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.406  -0.726   1.283  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.851   0.016   0.008  1.00  0.00           C  
+ATOM    137  O   TRP A   9       1.990  -0.082  -0.437  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.768   0.089   2.539  1.00  0.00           C  
+ATOM    139  CG  TRP A   9       0.100  -0.303   3.827  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.741  -0.899   4.856  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.285  -0.099   4.283  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.144  -1.128   5.885  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.417  -0.721   5.562  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.438   0.563   3.796  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.630  -0.795   6.256  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.651   0.550   4.515  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.762  -0.162   5.722  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.892  -2.196   1.706  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.679  -0.806   1.258  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.851   0.067   2.676  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.487   1.124   2.368  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.792  -1.157   4.866  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9       0.124  -1.512   6.782  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.400   1.113   2.871  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.690  -1.324   7.198  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.514   1.080   4.133  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.706  -0.204   6.249  1.00  0.00           H  
+ATOM    158  N   THR A  10      -0.076   0.794  -0.547  1.00  0.00           N  
+ATOM    159  CA  THR A  10      -0.028   1.475  -1.843  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.325   2.949  -1.612  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.386   3.273  -1.081  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -1.080   0.871  -2.792  1.00  0.00           C  
+ATOM    163  OG1 THR A  10      -0.990  -0.532  -2.768  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -0.870   1.291  -4.241  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.986   0.789  -0.096  1.00  0.00           H  
+ATOM    166  HA  THR A  10       0.959   1.360  -2.291  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -2.085   1.164  -2.476  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -1.004  -0.803  -1.846  1.00  0.00           H  
+ATOM    169 HG21 THR A  10       0.168   1.116  -4.523  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.515   0.681  -4.876  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.122   2.343  -4.372  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.617   3.840  -1.927  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.341   5.276  -1.927  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.391   5.639  -3.217  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.068   5.253  -4.293  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.636   6.089  -1.821  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.398   7.553  -1.612  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.506   8.506  -2.566  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.972   8.246  -0.399  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.172   9.734  -2.030  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.842   9.634  -0.694  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.675   7.839   0.920  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.445  10.576   0.270  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.320   8.778   1.905  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.206  10.140   1.585  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.460   3.526  -2.384  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.281   5.525  -1.068  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.235   5.712  -1.000  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.236   5.956  -2.721  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.788   8.317  -3.592  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.144  10.585  -2.569  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.744   6.795   1.165  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.342  11.618   0.002  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.132   8.450   2.916  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11      -0.062  10.847   2.359  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.477   6.417  -3.130  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.180   6.925  -4.320  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.131   8.451  -4.423  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -1.768   9.157  -3.489  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.619   6.389  -4.379  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.674   4.855  -4.274  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.036   4.295  -4.690  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.183   4.884  -3.868  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.469   4.320  -4.301  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.845   6.627  -2.206  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.670   6.552  -5.210  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -4.205   6.835  -3.575  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -4.056   6.686  -5.334  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -2.919   4.425  -4.934  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.456   4.548  -3.250  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.205   4.519  -5.746  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.024   3.212  -4.564  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.027   4.669  -2.810  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -6.204   5.965  -4.012  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -8.227   4.831  -3.874  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -7.539   4.394  -5.306  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.513   3.348  -4.031  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.507   8.974  -5.583  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.816   8.373  -6.330  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.462   9.973  -5.690  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       17                                                                  
+ATOM      1  N   SER A   1      -3.084   8.346  -0.550  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -2.981   7.812   0.820  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.820   6.293   0.826  1.00  0.00           C  
+ATOM      4  O   SER A   1      -3.084   5.610  -0.172  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.143   8.267   1.703  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -3.690   8.255   3.042  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.076   8.233   1.257  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -4.431   9.285   1.436  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.003   7.604   1.587  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -4.301   8.764   3.585  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -3.456   9.284  -0.522  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -3.690   7.756  -1.102  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.167   8.369  -0.973  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.229   5.786   1.912  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -1.936   4.369   2.090  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.175   3.466   1.990  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.039   3.445   2.860  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.070   4.141   3.337  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.276   4.805   3.275  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.666   5.858   4.030  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.435   4.447   2.452  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.980   6.174   3.739  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.518   5.304   2.813  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.706   3.460   1.474  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.804   5.167   2.266  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.992   3.312   0.920  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       4.042   4.156   1.321  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.051   6.418   2.682  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.349   4.101   1.228  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.602   4.471   4.234  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -0.894   3.072   3.450  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.044   6.355   4.764  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.491   6.925   4.186  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.940   2.769   1.162  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.610   5.817   2.573  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.180   2.531   0.196  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       5.030   4.021   0.905  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.242   2.753   0.863  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.300   1.888   0.357  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.717   0.474   0.341  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.612   0.255  -0.161  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.698   2.383  -1.049  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.065   3.749  -0.981  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.882   1.632  -1.665  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.449   2.832   0.231  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.176   1.930   1.007  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -3.839   2.292  -1.715  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.306   4.262  -0.650  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -5.615   0.594  -1.864  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.740   1.668  -0.993  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.157   2.110  -2.607  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.396  -0.477   0.980  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.945  -1.864   1.050  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.186  -2.623  -0.260  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.266  -2.559  -0.852  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.665  -2.540   2.222  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.598  -4.029   2.265  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.509  -4.861   1.714  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.618  -4.874   2.927  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -5.175  -6.167   2.008  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -4.038  -6.228   2.786  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.443  -4.631   3.670  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -3.358  -7.290   3.391  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.754  -5.690   4.288  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -2.221  -7.013   4.166  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.250  -0.240   1.460  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.869  -1.871   1.221  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.264  -2.153   3.156  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.721  -2.277   2.190  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.385  -4.532   1.165  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.747  -6.961   1.760  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.087  -3.615   3.775  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.727  -8.300   3.291  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.860  -5.489   4.864  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.703  -7.818   4.669  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.197  -3.426  -0.662  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.191  -4.117  -1.940  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.447  -5.462  -1.787  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.244  -5.472  -1.527  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.573  -3.166  -2.990  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.849  -3.549  -4.451  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -4.230  -3.100  -4.942  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -5.228  -3.718  -4.510  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -4.265  -2.147  -5.752  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.337  -3.452  -0.110  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.232  -4.279  -2.204  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.973  -2.161  -2.839  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.495  -3.109  -2.836  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.094  -3.071  -5.078  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -2.749  -4.624  -4.573  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.176  -6.592  -1.865  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.690  -7.984  -1.814  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.432  -8.217  -0.946  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.375  -8.614  -1.443  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.596  -8.558  -3.243  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.757  -7.735  -4.211  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.272  -7.067  -5.093  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.449  -7.779  -4.091  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.162  -6.477  -2.034  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.469  -8.574  -1.327  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.186  -9.568  -3.206  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -3.604  -8.630  -3.652  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.061  -8.225  -3.260  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6       0.074  -7.194  -4.716  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.577  -8.011   0.371  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.530  -8.230   1.371  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.268  -6.984   1.785  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.018  -7.084   2.754  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.478  -7.700   0.704  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.972  -8.658   2.271  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.181  -8.965   0.993  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.153  -5.837   1.087  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.039  -4.671   1.299  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.293  -3.318   1.293  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.853  -3.237   0.856  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.162  -4.783   0.243  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.317  -3.788   0.432  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.628  -4.266  -0.212  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.600  -3.083  -0.307  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       7.011  -3.498  -0.216  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.463  -5.820   0.275  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.491  -4.767   2.286  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.576  -5.791   0.305  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.743  -4.657  -0.758  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.027  -2.828   0.004  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       3.502  -3.659   1.498  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       5.054  -5.051   0.416  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.449  -4.672  -1.211  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.447  -2.568  -1.255  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       5.388  -2.391   0.508  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       7.601  -2.682  -0.296  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       7.176  -3.943   0.676  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       7.224  -4.142  -0.964  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.935  -2.241   1.778  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.453  -0.852   1.662  1.00  0.00           C  
+ATOM    136  C   TRP A   9       1.064  -0.167   0.432  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.283  -0.166   0.275  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.767  -0.034   2.935  1.00  0.00           C  
+ATOM    139  CG  TRP A   9       0.032  -0.478   4.167  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.574  -1.084   5.250  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.393  -0.336   4.463  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.425  -1.401   6.152  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.653  -0.940   5.730  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.488   0.259   3.800  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.938  -0.986   6.295  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.780   0.233   4.364  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.008  -0.398   5.601  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.872  -2.365   2.128  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.631  -0.854   1.541  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.843  -0.010   3.137  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.471   0.997   2.739  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.623  -1.316   5.380  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.271  -1.919   7.007  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.323   0.741   2.850  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.102  -1.475   7.243  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.610   0.661   3.821  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.007  -0.446   6.012  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.225   0.437  -0.419  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.630   1.313  -1.537  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.063   2.675  -1.469  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.924   2.914  -0.627  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.433   0.612  -2.891  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       1.042   1.372  -3.909  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -1.025   0.403  -3.296  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.778   0.380  -0.242  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.697   1.544  -1.464  1.00  0.00           H  
+ATOM    167  HB  THR A  10       0.929  -0.359  -2.846  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.345   1.716  -4.477  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -1.484   1.348  -3.591  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -1.061  -0.297  -4.131  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.591  -0.022  -2.469  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.415   3.615  -2.280  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.062   5.032  -2.274  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.534   5.450  -3.624  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.119   4.936  -4.664  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.355   5.820  -2.022  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.181   7.298  -1.928  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.235   8.150  -2.976  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.915   8.114  -0.750  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       0.978   9.432  -2.537  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.806   9.473  -1.169  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.765   7.847   0.628  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.583  10.519  -0.264  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.548   8.890   1.547  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.463  10.224   1.106  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.104   3.312  -2.960  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.643   5.260  -1.472  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       1.818   5.463  -1.104  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.065   5.620  -2.823  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.436   7.853  -3.998  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       0.927  10.236  -3.147  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.844   6.829   0.980  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.532  11.538  -0.619  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.454   8.662   2.600  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.316  11.020   1.821  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.454   6.424  -3.622  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -1.901   7.113  -4.841  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.134   8.604  -4.573  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -2.482   8.999  -3.466  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.095   6.405  -5.508  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.370   6.238  -4.663  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.558   5.821  -5.556  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.624   6.918  -5.663  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.451   6.993  -4.447  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.726   6.837  -2.739  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.078   7.062  -5.557  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.345   6.966  -6.410  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -2.767   5.412  -5.821  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.199   5.463  -3.913  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -4.600   7.171  -4.147  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.206   5.590  -6.562  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.018   4.916  -5.157  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -6.142   7.882  -5.827  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -7.274   6.702  -6.511  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -7.905   6.102  -4.293  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -6.865   7.211  -3.655  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -8.151   7.712  -4.561  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -1.941   9.450  -5.577  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.641   9.131  -6.485  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.059  10.429  -5.371  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       18                                                                  
+ATOM      1  N   SER A   1      -2.622   8.484   1.714  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.200   7.778   0.555  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.700   6.330   0.484  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.626   5.753  -0.601  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -2.890   8.546  -0.737  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -3.281   9.900  -0.616  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -4.284   7.752   0.680  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -1.821   8.500  -0.943  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -3.429   8.103  -1.573  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -4.184  10.003  -0.927  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.864   7.992   2.562  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -2.986   9.425   1.747  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -1.616   8.514   1.613  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.342   5.728   1.629  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.028   4.308   1.705  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.297   3.455   1.626  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.128   3.460   2.530  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.198   3.957   2.941  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.161   4.584   3.035  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.497   5.610   3.850  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.410   4.139   2.416  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.858   5.839   3.770  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.480   4.921   2.946  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.753   3.118   1.500  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.824   4.673   2.625  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       3.100   2.849   1.177  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       4.133   3.618   1.746  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.435   6.221   2.503  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.427   4.078   0.839  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.767   4.192   3.841  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.045   2.877   2.932  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.194   6.157   4.478  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.340   6.552   4.300  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.963   2.519   1.083  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.608   5.272   3.062  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.347   2.028   0.517  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       5.165   3.391   1.513  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.433   2.740   0.513  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.454   1.737   0.213  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.834   0.343   0.338  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.743   0.099  -0.183  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.995   1.969  -1.210  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -3.960   2.280  -2.129  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.969   3.151  -1.212  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.739   2.887  -0.217  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -5.278   1.820   0.922  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -5.528   1.079  -1.548  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -3.288   1.579  -2.139  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.316   3.340  -2.229  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.831   2.926  -0.582  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -5.475   4.048  -0.835  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.468  -0.562   1.089  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -4.021  -1.954   1.190  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -4.373  -2.727  -0.089  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.535  -2.795  -0.486  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.636  -2.608   2.432  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.254  -4.039   2.659  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.051  -5.109   2.431  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.032  -4.569   3.251  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.395  -6.262   2.815  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.175  -5.978   3.390  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -1.839  -3.999   3.741  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.229  -6.766   4.057  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -0.889  -4.774   4.426  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.099  -6.150   4.611  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.336  -0.317   1.542  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.938  -1.971   1.312  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.312  -2.044   3.312  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.723  -2.541   2.375  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -6.058  -5.053   2.034  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -4.812  -7.181   2.779  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.678  -2.948   3.606  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.395  -7.825   4.191  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.002  -4.310   4.837  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -0.380  -6.737   5.167  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -3.363  -3.312  -0.734  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -3.460  -4.033  -1.998  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.593  -5.306  -1.945  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -1.399  -5.247  -1.669  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -3.054  -3.083  -3.142  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -3.099  -3.761  -4.521  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -3.637  -2.832  -5.611  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -2.857  -1.970  -6.074  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -4.823  -3.003  -5.967  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -2.415  -3.212  -0.368  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -4.503  -4.310  -2.155  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.734  -2.228  -3.136  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -2.046  -2.707  -2.966  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.094  -4.089  -4.789  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -3.740  -4.642  -4.476  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -3.188  -6.476  -2.210  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.489  -7.757  -2.401  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.585  -8.245  -1.239  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.695  -9.061  -1.481  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -1.736  -7.710  -3.747  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -1.805  -9.037  -4.485  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -2.710  -9.282  -5.264  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -0.869  -9.933  -4.254  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -4.170  -6.456  -2.440  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.267  -8.514  -2.494  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.173  -6.956  -4.401  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -0.693  -7.434  -3.581  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.215  -9.788  -3.496  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -0.958 -10.794  -4.764  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.796  -7.778   0.003  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.897  -8.042   1.141  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.041  -6.872   1.492  1.00  0.00           C  
+ATOM    108  O   GLY A   7       0.839  -6.998   2.421  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.549  -7.116   0.130  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -1.473  -8.337   2.018  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7      -0.254  -8.899   0.929  1.00  0.00           H  
+ATOM    112  N   LYS A   8      -0.009  -5.751   0.750  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       0.927  -4.637   0.900  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.211  -3.273   0.865  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.759  -3.073   0.139  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       1.992  -4.781  -0.206  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.042  -3.663  -0.274  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.870  -3.486   1.009  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       4.797  -2.273   0.889  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       5.934  -2.530  -0.012  1.00  0.00           N  
+ATOM    121  H   LYS A   8      -0.635  -5.713  -0.053  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.417  -4.775   1.862  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.510  -5.731  -0.069  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       1.487  -4.816  -1.174  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       3.720  -3.886  -1.099  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       2.539  -2.730  -0.511  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       3.211  -3.318   1.859  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.460  -4.384   1.203  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       4.229  -1.419   0.518  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       5.184  -2.030   1.880  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       6.324  -3.439   0.194  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       5.618  -2.507  -0.971  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       6.641  -1.822   0.127  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.666  -2.305   1.662  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.226  -0.913   1.540  1.00  0.00           C  
+ATOM    136  C   TRP A   9       0.826  -0.245   0.278  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.027  -0.338   0.038  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.594  -0.147   2.829  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.135  -0.497   4.106  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.439  -1.057   5.196  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.509  -0.185   4.510  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.468  -1.094   6.235  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.660  -0.501   5.892  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.625   0.398   3.871  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -2.825  -0.210   6.616  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.810   0.680   4.580  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -3.904   0.398   5.955  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.448  -2.510   2.261  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.852  -0.913   1.409  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.671  -0.237   3.012  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.414   0.911   2.652  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.471  -1.378   5.256  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.254  -1.453   7.156  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.561   0.638   2.823  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -2.888  -0.442   7.667  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.662   1.095   4.064  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -4.807   0.643   6.498  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.008   0.491  -0.490  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.359   1.215  -1.733  1.00  0.00           C  
+ATOM    160  C   THR A  10      -0.091   2.680  -1.662  1.00  0.00           C  
+ATOM    161  O   THR A  10      -1.134   2.960  -1.078  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.327   0.575  -2.955  1.00  0.00           C  
+ATOM    163  OG1 THR A  10      -1.724   0.451  -2.755  1.00  0.00           O  
+ATOM    164  CG2 THR A  10       0.240  -0.802  -3.302  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.978   0.520  -0.243  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.439   1.191  -1.885  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -0.161   1.227  -3.812  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -1.868  -0.126  -1.990  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -0.133  -1.106  -4.283  1.00  0.00           H  
+ATOM    170 HG22 THR A  10       1.329  -0.758  -3.341  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -0.062  -1.539  -2.557  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.658   3.634  -2.236  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.351   5.073  -2.135  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.505   5.542  -3.329  1.00  0.00           C  
+ATOM    175  O   TRP A  11      -0.025   6.231  -4.228  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.648   5.882  -1.928  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.463   7.360  -1.730  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.538   8.301  -2.700  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       1.143   8.087  -0.506  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.257   9.545  -2.172  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       1.033   9.476  -0.814  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.923   7.707   0.833  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.735  10.445   0.158  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11       0.632   8.667   1.818  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11       0.539  10.034   1.489  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.483   3.375  -2.757  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.245   5.241  -1.238  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.152   5.491  -1.042  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.327   5.722  -2.765  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       1.745   8.089  -3.741  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.195  10.386  -2.728  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.992   6.662   1.090  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.661  11.488  -0.116  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11       0.480   8.337   2.831  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11       0.316  10.768   2.250  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.779   5.120  -3.358  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.700   5.332  -4.494  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -4.058   5.942  -4.103  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -4.796   6.416  -4.956  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -2.826   4.004  -5.269  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -3.458   4.140  -6.667  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -3.406   2.812  -7.436  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -3.983   2.980  -8.847  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -3.766   1.779  -9.674  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.066   4.541  -2.573  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -2.247   6.059  -5.171  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -1.821   3.595  -5.401  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -3.404   3.292  -4.678  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.498   4.451  -6.577  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -2.911   4.897  -7.232  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -2.369   2.480  -7.513  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -3.983   2.056  -6.901  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -5.054   3.174  -8.774  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -3.503   3.830  -9.332  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -4.191   1.912 -10.581  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -2.775   1.624  -9.791  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -4.181   0.975  -9.224  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -4.394   6.021  -2.824  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -3.767   5.690  -2.099  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -5.269   6.469  -2.605  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       19                                                                  
+ATOM      1  N   SER A   1      -3.475   9.462   0.192  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.445   8.427   1.241  1.00  0.00           C  
+ATOM      3  C   SER A   1      -2.699   7.168   0.792  1.00  0.00           C  
+ATOM      4  O   SER A   1      -2.261   7.044  -0.344  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -4.871   8.054   1.681  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -4.842   7.334   2.901  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -2.928   8.849   2.105  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.458   8.959   1.827  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.341   7.442   0.909  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -5.307   6.495   2.785  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.552   9.861   0.089  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -4.126  10.188   0.452  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -3.760   9.047  -0.684  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.569   6.267   1.746  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -2.152   4.873   1.567  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.345   3.988   1.221  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -4.486   4.267   1.591  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -1.520   4.413   2.887  1.00  0.00           C  
+ATOM     19  CG  TRP A   2      -0.168   4.977   3.163  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.133   5.980   4.024  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.102   4.484   2.647  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       1.509   6.186   4.015  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.157   5.241   3.233  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.455   3.442   1.772  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.506   4.944   2.987  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       2.803   3.142   1.498  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       3.827   3.888   2.111  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -3.009   6.488   2.625  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.422   4.822   0.754  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -2.192   4.660   3.713  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -1.423   3.329   2.865  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2      -0.584   6.560   4.577  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       1.962   6.918   4.534  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       0.661   2.850   1.348  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.288   5.516   3.461  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.054   2.315   0.851  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       4.860   3.638   1.914  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.096   2.896   0.501  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.067   1.855   0.153  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.411   0.475   0.244  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.277   0.299  -0.193  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.631   2.111  -1.252  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.160   3.419  -1.301  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -5.774   1.154  -1.592  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.147   2.774   0.131  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -4.889   1.892   0.866  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -3.842   2.014  -1.999  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -5.127   3.775  -0.404  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.329   1.537  -2.450  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -5.377   0.169  -1.843  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.458   1.067  -0.746  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.073  -0.465   0.923  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.675  -1.874   0.999  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -3.918  -2.580  -0.347  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -5.058  -2.658  -0.799  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.463  -2.525   2.144  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.197  -3.975   2.445  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -4.983  -5.002   2.041  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.173  -4.578   3.298  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.540  -6.179   2.610  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.435  -5.972   3.406  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.055  -4.103   4.001  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.678  -6.824   4.222  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.271  -4.936   4.811  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.593  -6.297   4.941  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -4.983  -0.236   1.292  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.616  -1.936   1.242  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.274  -1.971   3.041  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.527  -2.425   1.922  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -5.855  -4.888   1.410  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -5.017  -7.065   2.505  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -1.783  -3.091   3.891  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -2.939  -7.873   4.321  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.437  -4.516   5.343  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.000  -6.937   5.580  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -2.853  -3.060  -0.996  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -2.912  -3.847  -2.228  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -2.139  -5.160  -2.051  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -0.931  -5.163  -1.807  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -2.420  -3.037  -3.442  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -2.558  -3.818  -4.763  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -3.989  -4.297  -5.027  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -4.873  -3.421  -5.156  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -4.178  -5.530  -5.081  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -1.951  -3.023  -0.520  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -3.957  -4.096  -2.415  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -3.004  -2.119  -3.518  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -1.373  -2.764  -3.303  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -2.246  -3.178  -5.589  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -1.887  -4.679  -4.744  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.880  -6.271  -2.136  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.442  -7.667  -2.128  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.140  -7.940  -1.337  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.096  -8.275  -1.907  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.427  -8.196  -3.573  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -2.430  -9.716  -3.610  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -3.441 -10.351  -3.852  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -1.307 -10.336  -3.320  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.859  -6.127  -2.336  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.225  -8.225  -1.612  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -3.324  -7.859  -4.096  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -1.558  -7.814  -4.110  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -0.514  -9.779  -3.006  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -1.336 -11.340  -3.304  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.252  -7.872  -0.004  1.00  0.00           N  
+ATOM    106  CA  GLY A   7      -0.190  -8.206   0.946  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.556  -6.997   1.544  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.116  -7.134   2.617  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -2.139  -7.567   0.370  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.606  -8.792   1.767  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.556  -8.830   0.457  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.540  -5.840   0.870  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.275  -4.642   1.310  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.425  -3.373   1.235  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.694  -3.400   0.719  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.602  -4.535   0.528  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       2.443  -4.404  -0.999  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       3.810  -4.476  -1.703  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       3.709  -5.020  -3.133  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       3.338  -6.447  -3.150  1.00  0.00           N  
+ATOM    121  H   LYS A   8       0.047  -5.788  -0.011  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       1.534  -4.794   2.352  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       3.174  -3.680   0.897  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       3.185  -5.435   0.739  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       1.809  -5.215  -1.357  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       1.960  -3.458  -1.246  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       4.246  -3.476  -1.733  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       4.490  -5.124  -1.145  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       2.971  -4.444  -3.691  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       4.681  -4.910  -3.617  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       3.338  -6.788  -4.100  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.005  -6.974  -2.604  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       2.417  -6.561  -2.749  1.00  0.00           H  
+ATOM    134  N   TRP A   9       0.959  -2.253   1.716  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.390  -0.923   1.484  1.00  0.00           C  
+ATOM    136  C   TRP A   9       1.145  -0.264   0.319  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.346  -0.475   0.156  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.489  -0.023   2.736  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.321  -0.357   3.964  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.150  -1.001   5.057  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.675   0.074   4.309  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.821  -1.005   6.033  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.946  -0.312   5.646  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.668   0.823   3.652  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.134   0.026   6.300  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.865   1.180   4.295  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.100   0.781   5.618  1.00  0.00           C  
+ATOM    148  H   TRP A   9       1.912  -2.302   2.052  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.660  -1.009   1.210  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.535   0.106   3.029  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.144   0.963   2.434  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.138  -1.428   5.144  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.699  -1.437   6.943  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.512   1.134   2.624  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.308  -0.288   7.324  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.616   1.757   3.767  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.025   1.058   6.112  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.475   0.646  -0.388  1.00  0.00           N  
+ATOM    159  CA  THR A  10       1.042   1.536  -1.410  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.430   2.931  -1.253  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.742   3.057  -0.911  1.00  0.00           O  
+ATOM    162  CB  THR A  10       0.847   0.958  -2.824  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       1.222   1.910  -3.800  1.00  0.00           O  
+ATOM    164  CG2 THR A  10      -0.574   0.469  -3.131  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.532   0.716  -0.238  1.00  0.00           H  
+ATOM    166  HA  THR A  10       2.116   1.628  -1.243  1.00  0.00           H  
+ATOM    167  HB  THR A  10       1.515   0.103  -2.925  1.00  0.00           H  
+ATOM    168  HG1 THR A  10       0.554   2.606  -3.869  1.00  0.00           H  
+ATOM    169 HG21 THR A  10      -0.650   0.209  -4.186  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -0.783  -0.426  -2.543  1.00  0.00           H  
+ATOM    171 HG23 THR A  10      -1.310   1.236  -2.888  1.00  0.00           H  
+ATOM    172  N   TRP A  11       1.206   3.983  -1.508  1.00  0.00           N  
+ATOM    173  CA  TRP A  11       0.673   5.344  -1.576  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.148   5.514  -2.867  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.145   4.873  -3.883  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.839   6.342  -1.479  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       1.478   7.790  -1.335  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       1.695   8.759  -2.255  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.879   8.461  -0.187  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11       1.283   9.978  -1.749  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11       0.767   9.851  -0.474  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.428   8.029   1.076  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11       0.245  10.772   0.450  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11      -0.104   8.936   2.010  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11      -0.192  10.305   1.702  1.00  0.00           C  
+ATOM    186  H   TRP A  11       2.159   3.830  -1.790  1.00  0.00           H  
+ATOM    187  HA  TRP A  11       0.014   5.517  -0.730  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       2.423   6.080  -0.593  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       2.498   6.226  -2.338  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       2.160   8.600  -3.221  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11       1.393  10.855  -2.240  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.495   6.979   1.320  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11       0.203  11.825   0.209  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11      -0.446   8.572   2.953  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11      -0.579  10.991   2.442  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.160   6.394  -2.832  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.020   6.760  -3.971  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.348   8.261  -4.021  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -2.711   8.782  -5.068  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.302   5.900  -3.928  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.075   5.914  -5.262  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -5.131   4.799  -5.336  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -4.555   3.557  -6.027  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -5.252   2.325  -5.624  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -1.398   6.758  -1.913  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.490   6.527  -4.895  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.028   4.869  -3.695  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -3.958   6.261  -3.132  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.574   6.877  -5.371  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -3.374   5.800  -6.093  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.473   4.550  -4.330  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -5.989   5.149  -5.914  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -4.642   3.682  -7.108  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -3.501   3.463  -5.770  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -6.205   2.342  -5.958  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -4.771   1.526  -6.015  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -5.249   2.256  -4.616  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.194   8.996  -2.925  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -1.896   8.575  -2.059  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -2.393   9.979  -3.002  1.00  0.00           H  
+ENDMDL                                                                          
+MODEL       20                                                                  
+ATOM      1  N   SER A   1      -3.111   8.654  -0.154  1.00  0.00           N  
+ATOM      2  CA  SER A   1      -3.568   7.913   1.032  1.00  0.00           C  
+ATOM      3  C   SER A   1      -3.016   6.492   0.982  1.00  0.00           C  
+ATOM      4  O   SER A   1      -3.273   5.775   0.006  1.00  0.00           O  
+ATOM      5  CB  SER A   1      -5.100   7.885   1.101  1.00  0.00           C  
+ATOM      6  OG  SER A   1      -5.625   9.185   0.913  1.00  0.00           O  
+ATOM      7  HA  SER A   1      -3.195   8.421   1.921  1.00  0.00           H  
+ATOM      8  HB2 SER A   1      -5.492   7.224   0.327  1.00  0.00           H  
+ATOM      9  HB3 SER A   1      -5.409   7.516   2.080  1.00  0.00           H  
+ATOM     10  HG  SER A   1      -6.586   9.142   0.940  1.00  0.00           H  
+ATOM     11  H1  SER A   1      -2.396   9.313   0.121  1.00  0.00           H  
+ATOM     12  H2  SER A   1      -3.889   9.151  -0.563  1.00  0.00           H  
+ATOM     13  H3  SER A   1      -2.727   8.004  -0.825  1.00  0.00           H  
+ATOM     14  N   TRP A   2      -2.234   6.083   1.992  1.00  0.00           N  
+ATOM     15  CA  TRP A   2      -1.826   4.683   2.117  1.00  0.00           C  
+ATOM     16  C   TRP A   2      -3.035   3.742   2.086  1.00  0.00           C  
+ATOM     17  O   TRP A   2      -3.884   3.760   2.974  1.00  0.00           O  
+ATOM     18  CB  TRP A   2      -0.910   4.404   3.316  1.00  0.00           C  
+ATOM     19  CG  TRP A   2       0.433   5.068   3.257  1.00  0.00           C  
+ATOM     20  CD1 TRP A   2       0.800   6.134   4.001  1.00  0.00           C  
+ATOM     21  CD2 TRP A   2       1.606   4.721   2.446  1.00  0.00           C  
+ATOM     22  NE1 TRP A   2       2.096   6.494   3.692  1.00  0.00           N  
+ATOM     23  CE2 TRP A   2       2.655   5.635   2.769  1.00  0.00           C  
+ATOM     24  CE3 TRP A   2       1.908   3.725   1.488  1.00  0.00           C  
+ATOM     25  CZ2 TRP A   2       3.933   5.558   2.196  1.00  0.00           C  
+ATOM     26  CZ3 TRP A   2       3.188   3.635   0.902  1.00  0.00           C  
+ATOM     27  CH2 TRP A   2       4.203   4.544   1.260  1.00  0.00           C  
+ATOM     28  H   TRP A   2      -2.000   6.720   2.738  1.00  0.00           H  
+ATOM     29  HA  TRP A   2      -1.254   4.469   1.231  1.00  0.00           H  
+ATOM     30  HB2 TRP A   2      -1.420   4.681   4.241  1.00  0.00           H  
+ATOM     31  HB3 TRP A   2      -0.735   3.327   3.359  1.00  0.00           H  
+ATOM     32  HD1 TRP A   2       0.167   6.623   4.729  1.00  0.00           H  
+ATOM     33  HE1 TRP A   2       2.573   7.282   4.108  1.00  0.00           H  
+ATOM     34  HE3 TRP A   2       1.149   3.008   1.221  1.00  0.00           H  
+ATOM     35  HZ2 TRP A   2       4.703   6.260   2.483  1.00  0.00           H  
+ATOM     36  HZ3 TRP A   2       3.403   2.853   0.185  1.00  0.00           H  
+ATOM     37  HH2 TRP A   2       5.188   4.456   0.823  1.00  0.00           H  
+ATOM     38  N   THR A   3      -3.112   2.967   1.003  1.00  0.00           N  
+ATOM     39  CA  THR A   3      -4.193   2.061   0.623  1.00  0.00           C  
+ATOM     40  C   THR A   3      -3.596   0.663   0.420  1.00  0.00           C  
+ATOM     41  O   THR A   3      -2.405   0.525   0.139  1.00  0.00           O  
+ATOM     42  CB  THR A   3      -4.885   2.568  -0.655  1.00  0.00           C  
+ATOM     43  OG1 THR A   3      -5.162   3.953  -0.584  1.00  0.00           O  
+ATOM     44  CG2 THR A   3      -6.233   1.870  -0.845  1.00  0.00           C  
+ATOM     45  H   THR A   3      -2.328   3.020   0.357  1.00  0.00           H  
+ATOM     46  HA  THR A   3      -4.935   2.024   1.422  1.00  0.00           H  
+ATOM     47  HB  THR A   3      -4.245   2.377  -1.518  1.00  0.00           H  
+ATOM     48  HG1 THR A   3      -4.349   4.449  -0.362  1.00  0.00           H  
+ATOM     49 HG21 THR A   3      -6.729   2.270  -1.729  1.00  0.00           H  
+ATOM     50 HG22 THR A   3      -6.097   0.798  -0.981  1.00  0.00           H  
+ATOM     51 HG23 THR A   3      -6.867   2.051   0.025  1.00  0.00           H  
+ATOM     52  N   TRP A   4      -4.361  -0.389   0.708  1.00  0.00           N  
+ATOM     53  CA  TRP A   4      -3.836  -1.752   0.698  1.00  0.00           C  
+ATOM     54  C   TRP A   4      -3.868  -2.425  -0.678  1.00  0.00           C  
+ATOM     55  O   TRP A   4      -4.913  -2.507  -1.324  1.00  0.00           O  
+ATOM     56  CB  TRP A   4      -4.589  -2.568   1.754  1.00  0.00           C  
+ATOM     57  CG  TRP A   4      -4.326  -4.039   1.761  1.00  0.00           C  
+ATOM     58  CD1 TRP A   4      -5.026  -4.973   1.078  1.00  0.00           C  
+ATOM     59  CD2 TRP A   4      -3.337  -4.768   2.538  1.00  0.00           C  
+ATOM     60  NE1 TRP A   4      -4.554  -6.231   1.402  1.00  0.00           N  
+ATOM     61  CE2 TRP A   4      -3.548  -6.161   2.344  1.00  0.00           C  
+ATOM     62  CE3 TRP A   4      -2.318  -4.385   3.429  1.00  0.00           C  
+ATOM     63  CZ2 TRP A   4      -2.813  -7.129   3.043  1.00  0.00           C  
+ATOM     64  CZ3 TRP A   4      -1.570  -5.341   4.135  1.00  0.00           C  
+ATOM     65  CH2 TRP A   4      -1.825  -6.711   3.953  1.00  0.00           C  
+ATOM     66  H   TRP A   4      -5.325  -0.249   0.968  1.00  0.00           H  
+ATOM     67  HA  TRP A   4      -2.786  -1.697   0.968  1.00  0.00           H  
+ATOM     68  HB2 TRP A   4      -4.328  -2.173   2.736  1.00  0.00           H  
+ATOM     69  HB3 TRP A   4      -5.663  -2.427   1.633  1.00  0.00           H  
+ATOM     70  HD1 TRP A   4      -5.855  -4.753   0.414  1.00  0.00           H  
+ATOM     71  HE1 TRP A   4      -4.964  -7.083   1.046  1.00  0.00           H  
+ATOM     72  HE3 TRP A   4      -2.138  -3.333   3.582  1.00  0.00           H  
+ATOM     73  HZ2 TRP A   4      -3.009  -8.179   2.886  1.00  0.00           H  
+ATOM     74  HZ3 TRP A   4      -0.811  -5.017   4.835  1.00  0.00           H  
+ATOM     75  HH2 TRP A   4      -1.255  -7.440   4.512  1.00  0.00           H  
+ATOM     76  N   GLU A   5      -2.724  -2.999  -1.070  1.00  0.00           N  
+ATOM     77  CA  GLU A   5      -2.552  -3.833  -2.251  1.00  0.00           C  
+ATOM     78  C   GLU A   5      -1.991  -5.202  -1.843  1.00  0.00           C  
+ATOM     79  O   GLU A   5      -0.790  -5.355  -1.631  1.00  0.00           O  
+ATOM     80  CB  GLU A   5      -1.647  -3.123  -3.273  1.00  0.00           C  
+ATOM     81  CG  GLU A   5      -1.413  -3.920  -4.569  1.00  0.00           C  
+ATOM     82  CD  GLU A   5      -2.659  -4.018  -5.451  1.00  0.00           C  
+ATOM     83  OE1 GLU A   5      -3.585  -4.763  -5.064  1.00  0.00           O  
+ATOM     84  OE2 GLU A   5      -2.658  -3.357  -6.514  1.00  0.00           O  
+ATOM     85  H   GLU A   5      -1.890  -2.901  -0.492  1.00  0.00           H  
+ATOM     86  HA  GLU A   5      -3.529  -3.972  -2.708  1.00  0.00           H  
+ATOM     87  HB2 GLU A   5      -2.080  -2.156  -3.528  1.00  0.00           H  
+ATOM     88  HB3 GLU A   5      -0.677  -2.951  -2.807  1.00  0.00           H  
+ATOM     89  HG2 GLU A   5      -0.620  -3.426  -5.133  1.00  0.00           H  
+ATOM     90  HG3 GLU A   5      -1.061  -4.925  -4.334  1.00  0.00           H  
+ATOM     91  N   ASN A   6      -2.885  -6.186  -1.705  1.00  0.00           N  
+ATOM     92  CA  ASN A   6      -2.633  -7.626  -1.565  1.00  0.00           C  
+ATOM     93  C   ASN A   6      -1.295  -8.010  -0.896  1.00  0.00           C  
+ATOM     94  O   ASN A   6      -0.433  -8.646  -1.501  1.00  0.00           O  
+ATOM     95  CB  ASN A   6      -2.878  -8.264  -2.947  1.00  0.00           C  
+ATOM     96  CG  ASN A   6      -4.325  -8.059  -3.385  1.00  0.00           C  
+ATOM     97  OD1 ASN A   6      -5.241  -8.026  -2.578  1.00  0.00           O  
+ATOM     98  ND2 ASN A   6      -4.584  -7.872  -4.661  1.00  0.00           N  
+ATOM     99  H   ASN A   6      -3.850  -5.931  -1.861  1.00  0.00           H  
+ATOM    100  HA  ASN A   6      -3.400  -8.025  -0.901  1.00  0.00           H  
+ATOM    101  HB2 ASN A   6      -2.201  -7.818  -3.677  1.00  0.00           H  
+ATOM    102  HB3 ASN A   6      -2.683  -9.335  -2.900  1.00  0.00           H  
+ATOM    103 HD21 ASN A   6      -3.869  -7.850  -5.367  1.00  0.00           H  
+ATOM    104 HD22 ASN A   6      -5.555  -7.698  -4.855  1.00  0.00           H  
+ATOM    105  N   GLY A   7      -1.169  -7.668   0.392  1.00  0.00           N  
+ATOM    106  CA  GLY A   7       0.004  -7.904   1.238  1.00  0.00           C  
+ATOM    107  C   GLY A   7       0.893  -6.683   1.494  1.00  0.00           C  
+ATOM    108  O   GLY A   7       1.699  -6.745   2.421  1.00  0.00           O  
+ATOM    109  H   GLY A   7      -1.922  -7.137   0.806  1.00  0.00           H  
+ATOM    110  HA2 GLY A   7      -0.326  -8.287   2.202  1.00  0.00           H  
+ATOM    111  HA3 GLY A   7       0.631  -8.673   0.783  1.00  0.00           H  
+ATOM    112  N   LYS A   8       0.757  -5.584   0.731  1.00  0.00           N  
+ATOM    113  CA  LYS A   8       1.609  -4.387   0.824  1.00  0.00           C  
+ATOM    114  C   LYS A   8       0.770  -3.092   0.898  1.00  0.00           C  
+ATOM    115  O   LYS A   8      -0.313  -2.997   0.318  1.00  0.00           O  
+ATOM    116  CB  LYS A   8       2.603  -4.399  -0.366  1.00  0.00           C  
+ATOM    117  CG  LYS A   8       3.502  -5.660  -0.460  1.00  0.00           C  
+ATOM    118  CD  LYS A   8       4.453  -5.801   0.745  1.00  0.00           C  
+ATOM    119  CE  LYS A   8       5.290  -7.088   0.764  1.00  0.00           C  
+ATOM    120  NZ  LYS A   8       4.500  -8.283   1.122  1.00  0.00           N  
+ATOM    121  H   LYS A   8       0.096  -5.614  -0.047  1.00  0.00           H  
+ATOM    122  HA  LYS A   8       2.181  -4.432   1.749  1.00  0.00           H  
+ATOM    123  HB2 LYS A   8       2.037  -4.318  -1.295  1.00  0.00           H  
+ATOM    124  HB3 LYS A   8       3.250  -3.523  -0.299  1.00  0.00           H  
+ATOM    125  HG2 LYS A   8       2.884  -6.554  -0.555  1.00  0.00           H  
+ATOM    126  HG3 LYS A   8       4.105  -5.588  -1.368  1.00  0.00           H  
+ATOM    127  HD2 LYS A   8       5.136  -4.953   0.736  1.00  0.00           H  
+ATOM    128  HD3 LYS A   8       3.890  -5.760   1.672  1.00  0.00           H  
+ATOM    129  HE2 LYS A   8       5.766  -7.239  -0.203  1.00  0.00           H  
+ATOM    130  HE3 LYS A   8       6.067  -6.969   1.520  1.00  0.00           H  
+ATOM    131  HZ1 LYS A   8       5.112  -9.084   1.172  1.00  0.00           H  
+ATOM    132  HZ2 LYS A   8       4.063  -8.143   2.023  1.00  0.00           H  
+ATOM    133  HZ3 LYS A   8       3.789  -8.448   0.425  1.00  0.00           H  
+ATOM    134  N   TRP A   9       1.256  -2.072   1.618  1.00  0.00           N  
+ATOM    135  CA  TRP A   9       0.633  -0.737   1.660  1.00  0.00           C  
+ATOM    136  C   TRP A   9       1.199   0.126   0.522  1.00  0.00           C  
+ATOM    137  O   TRP A   9       2.413   0.240   0.363  1.00  0.00           O  
+ATOM    138  CB  TRP A   9       0.822  -0.043   3.028  1.00  0.00           C  
+ATOM    139  CG  TRP A   9      -0.060  -0.501   4.163  1.00  0.00           C  
+ATOM    140  CD1 TRP A   9       0.368  -1.128   5.284  1.00  0.00           C  
+ATOM    141  CD2 TRP A   9      -1.498  -0.288   4.364  1.00  0.00           C  
+ATOM    142  NE1 TRP A   9      -0.701  -1.359   6.131  1.00  0.00           N  
+ATOM    143  CE2 TRP A   9      -1.879  -0.875   5.609  1.00  0.00           C  
+ATOM    144  CE3 TRP A   9      -2.512   0.389   3.655  1.00  0.00           C  
+ATOM    145  CZ2 TRP A   9      -3.201  -0.857   6.085  1.00  0.00           C  
+ATOM    146  CZ3 TRP A   9      -3.835   0.447   4.136  1.00  0.00           C  
+ATOM    147  CH2 TRP A   9      -4.189  -0.195   5.334  1.00  0.00           C  
+ATOM    148  H   TRP A   9       2.171  -2.174   2.029  1.00  0.00           H  
+ATOM    149  HA  TRP A   9      -0.441  -0.840   1.496  1.00  0.00           H  
+ATOM    150  HB2 TRP A   9       1.869  -0.103   3.336  1.00  0.00           H  
+ATOM    151  HB3 TRP A   9       0.609   1.018   2.888  1.00  0.00           H  
+ATOM    152  HD1 TRP A   9       1.396  -1.398   5.488  1.00  0.00           H  
+ATOM    153  HE1 TRP A   9      -0.614  -1.788   7.041  1.00  0.00           H  
+ATOM    154  HE3 TRP A   9      -2.255   0.898   2.742  1.00  0.00           H  
+ATOM    155  HZ2 TRP A   9      -3.459  -1.339   7.016  1.00  0.00           H  
+ATOM    156  HZ3 TRP A   9      -4.591   0.978   3.576  1.00  0.00           H  
+ATOM    157  HH2 TRP A   9      -5.212  -0.168   5.683  1.00  0.00           H  
+ATOM    158  N   THR A  10       0.310   0.768  -0.238  1.00  0.00           N  
+ATOM    159  CA  THR A  10       0.584   1.515  -1.477  1.00  0.00           C  
+ATOM    160  C   THR A  10       0.035   2.941  -1.364  1.00  0.00           C  
+ATOM    161  O   THR A  10      -0.818   3.185  -0.524  1.00  0.00           O  
+ATOM    162  CB  THR A  10      -0.084   0.782  -2.656  1.00  0.00           C  
+ATOM    163  OG1 THR A  10       0.335  -0.562  -2.680  1.00  0.00           O  
+ATOM    164  CG2 THR A  10       0.265   1.375  -4.020  1.00  0.00           C  
+ATOM    165  H   THR A  10      -0.676   0.686   0.006  1.00  0.00           H  
+ATOM    166  HA  THR A  10       1.660   1.557  -1.648  1.00  0.00           H  
+ATOM    167  HB  THR A  10      -1.168   0.802  -2.531  1.00  0.00           H  
+ATOM    168  HG1 THR A  10      -0.126  -1.028  -1.978  1.00  0.00           H  
+ATOM    169 HG21 THR A  10       0.013   0.656  -4.799  1.00  0.00           H  
+ATOM    170 HG22 THR A  10      -0.312   2.283  -4.190  1.00  0.00           H  
+ATOM    171 HG23 THR A  10       1.331   1.592  -4.071  1.00  0.00           H  
+ATOM    172  N   TRP A  11       0.518   3.897  -2.164  1.00  0.00           N  
+ATOM    173  CA  TRP A  11      -0.024   5.268  -2.282  1.00  0.00           C  
+ATOM    174  C   TRP A  11      -0.579   5.503  -3.696  1.00  0.00           C  
+ATOM    175  O   TRP A  11       0.165   5.383  -4.668  1.00  0.00           O  
+ATOM    176  CB  TRP A  11       1.078   6.274  -1.934  1.00  0.00           C  
+ATOM    177  CG  TRP A  11       0.585   7.674  -1.754  1.00  0.00           C  
+ATOM    178  CD1 TRP A  11       0.372   8.596  -2.721  1.00  0.00           C  
+ATOM    179  CD2 TRP A  11       0.235   8.319  -0.499  1.00  0.00           C  
+ATOM    180  NE1 TRP A  11      -0.092   9.766  -2.142  1.00  0.00           N  
+ATOM    181  CE2 TRP A  11      -0.187   9.652  -0.770  1.00  0.00           C  
+ATOM    182  CE3 TRP A  11       0.244   7.898   0.843  1.00  0.00           C  
+ATOM    183  CZ2 TRP A  11      -0.591  10.526   0.252  1.00  0.00           C  
+ATOM    184  CZ3 TRP A  11      -0.142   8.768   1.878  1.00  0.00           C  
+ATOM    185  CH2 TRP A  11      -0.563  10.077   1.585  1.00  0.00           C  
+ATOM    186  H   TRP A  11       1.264   3.660  -2.801  1.00  0.00           H  
+ATOM    187  HA  TRP A  11      -0.829   5.482  -1.567  1.00  0.00           H  
+ATOM    188  HB2 TRP A  11       1.527   5.965  -0.991  1.00  0.00           H  
+ATOM    189  HB3 TRP A  11       1.875   6.263  -2.677  1.00  0.00           H  
+ATOM    190  HD1 TRP A  11       0.551   8.438  -3.779  1.00  0.00           H  
+ATOM    191  HE1 TRP A  11      -0.284  10.612  -2.661  1.00  0.00           H  
+ATOM    192  HE3 TRP A  11       0.573   6.894   1.066  1.00  0.00           H  
+ATOM    193  HZ2 TRP A  11      -0.921  11.528   0.019  1.00  0.00           H  
+ATOM    194  HZ3 TRP A  11      -0.104   8.433   2.902  1.00  0.00           H  
+ATOM    195  HH2 TRP A  11      -0.858  10.735   2.391  1.00  0.00           H  
+ATOM    196  N   LYS A  12      -1.864   5.890  -3.808  1.00  0.00           N  
+ATOM    197  CA  LYS A  12      -2.488   6.336  -5.074  1.00  0.00           C  
+ATOM    198  C   LYS A  12      -2.954   7.800  -5.074  1.00  0.00           C  
+ATOM    199  O   LYS A  12      -3.455   8.287  -6.078  1.00  0.00           O  
+ATOM    200  CB  LYS A  12      -3.603   5.374  -5.539  1.00  0.00           C  
+ATOM    201  CG  LYS A  12      -4.926   5.443  -4.753  1.00  0.00           C  
+ATOM    202  CD  LYS A  12      -6.011   4.552  -5.384  1.00  0.00           C  
+ATOM    203  CE  LYS A  12      -6.638   5.149  -6.653  1.00  0.00           C  
+ATOM    204  NZ  LYS A  12      -7.723   4.287  -7.156  1.00  0.00           N  
+ATOM    205  H   LYS A  12      -2.429   5.887  -2.967  1.00  0.00           H  
+ATOM    206  HA  LYS A  12      -1.725   6.291  -5.853  1.00  0.00           H  
+ATOM    207  HB2 LYS A  12      -3.817   5.607  -6.584  1.00  0.00           H  
+ATOM    208  HB3 LYS A  12      -3.224   4.351  -5.505  1.00  0.00           H  
+ATOM    209  HG2 LYS A  12      -4.747   5.100  -3.733  1.00  0.00           H  
+ATOM    210  HG3 LYS A  12      -5.296   6.470  -4.710  1.00  0.00           H  
+ATOM    211  HD2 LYS A  12      -5.586   3.576  -5.620  1.00  0.00           H  
+ATOM    212  HD3 LYS A  12      -6.806   4.413  -4.652  1.00  0.00           H  
+ATOM    213  HE2 LYS A  12      -7.045   6.134  -6.423  1.00  0.00           H  
+ATOM    214  HE3 LYS A  12      -5.880   5.255  -7.430  1.00  0.00           H  
+ATOM    215  HZ1 LYS A  12      -8.382   4.109  -6.411  1.00  0.00           H  
+ATOM    216  HZ2 LYS A  12      -8.200   4.744  -7.921  1.00  0.00           H  
+ATOM    217  HZ3 LYS A  12      -7.338   3.411  -7.476  1.00  0.00           H  
+TER     218      LYS A  12                                                      
+HETATM  219  N   NH2 A  13      -2.799   8.529  -3.976  1.00  0.00           N  
+HETATM  220  HN1 NH2 A  13      -2.344   8.154  -3.161  1.00  0.00           H  
+HETATM  221  HN2 NH2 A  13      -3.144   9.474  -4.010  1.00  0.00           H  
+ENDMDL                                                                          
+CONECT  198  219                                                                
+CONECT  219  198  220  221                                                      
+CONECT  220  219                                                                
+CONECT  221  219                                                                
+MASTER      108    0    1    0    2    0    0    6 4400   20    4    1          
+END                                                                             

diff --git a/source/ga/input-templates/galera/1L2Y_mremd.tpl b/source/ga/input-templates/galera/1L2Y_mremd.tpl
new file mode 100644 (file)
index 0000000..6eec1c8
--- /dev/null
+++ b/source/ga/input-templates/galera/1L2Y_mremd.tpl
@@ -0,0 +1,13 @@
+1LE1 random parameters #1
+SEED=-6086648 RE pdbref refstr ONE_LETTER  rescale_mode=2 out1file extconf
+nstep=5000000  ntwe=10000 ntwx=10000 lang=0 tbf t_bath=300 tau_bath=1.0        &
+dt=0.10 reset_moment=1000 reset_vel=10000 damax=4.0
+nrep=20 nstex=10000 tlist mlist traj1file rest1file sync nsyn=10000 hremd={POPSIZE} tonly
+ 250 260 270 280 290 300 310 320 330 340 350 360 370 380 390 400 420 440 460 500
+   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1
+{WEIGHTS}
+{PREFIX}.pdb
+14
+XSWTWENGKWTWKX
+0
+0

diff --git a/source/ga/input-templates/galera/1L2Y_wham.tpl b/source/ga/input-templates/galera/1L2Y_wham.tpl
new file mode 100644 (file)
index 0000000..9ccdb3e
--- /dev/null
+++ b/source/ga/input-templates/galera/1L2Y_wham.tpl
@@ -0,0 +1,53 @@
+SEED=-3059743 n_ene=19 isampl=1  nparmset=1 nq=1 classify pdbref einicheck=1   &
+rescale=2 ensembles=1 cxfile nslice=5 
+nres=14 one_letter
+XSWTWENGKWTWKX
+0
+{WEIGHTS}
+NT=20 replica umbrella
+NR=1 TEMP= 250.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 260.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 270.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 280.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 290.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 300.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 310.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 320.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 330.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 340.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 350.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 360.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 370.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 380.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 390.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 400.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 420.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 440.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 460.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 500.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+nfile_cx=1 rec_start=1   rec_end=500    totraj=20
+../{PREFIX}_MD000
+CUTOFF_UP=8.0 CUTOFF_LOW=4.0 NLEVEL=-2 PDBREF                                  &
+SPLIT_BET=1 NC_FRAC_HEL=0.7 NC_FRAC_BET=0.5 NC_FRAC_PAIR=0.5 NSHIFT_PAIR=3     &
+CONT_PAIR=1 NC_FRAC_PAIR=0.5 RMS_PAIR=0
+../{PREFIX}.pdb

diff --git a/source/ga/input-templates/galera/1LE1_mremd.tpl b/source/ga/input-templates/galera/1LE1_mremd.tpl
new file mode 100644 (file)
index 0000000..b36236a
--- /dev/null
+++ b/source/ga/input-templates/galera/1LE1_mremd.tpl
@@ -0,0 +1,14 @@
+1LE1 random parameters #1
+SEED=-6086648 RE pdbref refstr ONE_LETTER  rescale_mode=2 out1file extconf
+nstep=2000000  ntwe=10000 ntwx=10000 lang=0 tbf t_bath=300 tau_bath=1.0        &
+dt=0.10 reset_moment=1000 reset_vel=10000 damax=4.0 
+nrep=16 nstex=10000 tlist mlist traj1file rest1file sync nsyn=10000 tonly      &
+hremd={POPSIZE}
+ 250 260 270 280 290 300 310 320 330 340 350 360 370 380 390 400
+   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1
+{WEIGHTS}
+{PREFIX}.pdb
+14
+XSWTWENGKWTWKX
+0
+0

diff --git a/source/ga/input-templates/galera/1LE1_wham.tpl b/source/ga/input-templates/galera/1LE1_wham.tpl
new file mode 100644 (file)
index 0000000..f68f1e3
--- /dev/null
+++ b/source/ga/input-templates/galera/1LE1_wham.tpl
@@ -0,0 +1,46 @@
+SEED=-3059743 n_ene=19 isampl=1 nq=1 classify pdbref einicheck=1               &
+rescale=2 ensembles=0 nslice=1 HAMIL_REP oneletter cxfile separate_parset      &
+nparmset={POPSIZE}
+nres=14 one_letter
+XSWTWENGKWTWKX
+0
+{WEIGHTS}
+NT=16 replica
+NR=1 TEMP= 250.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 260.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 270.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 280.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 290.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 300.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 310.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 320.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 330.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 340.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 350.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 360.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 370.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 380.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 390.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 400.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+nfile_cx=1 rec_start=101   rec_end=200    totraj=256
+./{PREFIX}_mremd_MD000
+CUTOFF_UP=8.0 CUTOFF_LOW=4.0 NLEVEL=-2 PDBREF                                  &
+SPLIT_BET=1 NC_FRAC_HEL=0.7 NC_FRAC_BET=0.5 NC_FRAC_PAIR=0.5 NSHIFT_PAIR=3     &
+CONT_PAIR=1 NC_FRAC_PAIR=0.5 RMS_PAIR=0
+./{PREFIX}.pdb

diff --git a/source/ga/input-templates/galera/opt.csh b/source/ga/input-templates/galera/opt.csh
new file mode 100755 (executable)
index 0000000..a83215e
--- /dev/null
+++ b/source/ga/input-templates/galera/opt.csh
@@ -0,0 +1,73 @@
+#!/bin/csh -f
+# Script to run the program zscorezi_MPI on linux with MPICH (parallel version).
+#
+
+echo "This job is running on host `hostname` "
+
+set DD = /users/kdm/lightnir/PARAM
+set BIN = /users/kdm/adaml/UNRES/bin
+
+set POT = GB
+setenv POT GB
+
+setenv PREFIX zscore
+setenv SCRATCHDIR /tmp/`whoami`
+
+if ( ! -d $SCRATCHDIR ) then
+  mkdir $SCRATCHDIR 
+endif
+
+
+hostname
+ls *.cx
+
+hostname
+ls -l /tmp
+
+#
+# Is the specified potential in the list of valid force fields?
+#
+if (($POT != "LJ") && ($POT != "LJK") && ($POT != "BP") && ($POT != "GB") \
+&& ($POT != "GBV") ) then
+  echo "Unknown potential type $POT"
+  exit(1)
+endif
+
+# 5/17/97 parameter file assignment was changed from link to SETENV statements
+#
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+#setenv BONDPAR $DD/bond.parm
+#setenv THETPAR $DD/thetaml.5parm
+#setenv ROTPAR $DD/scgauss.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+
+# Set parallel environment, depending on job type (interactive or batch).
+
+set DEBUG = 0
+
+# Choose the sidechain contact function
+
+setenv CONTFUNC GB
+if (${CONTFUNC} == "GB") then
+  setenv SIDEP ${DD}/contact.3.parm
+else if (${CONTFUNC} == "SCDIST") then
+  setenv SIDEP ${DD}/cend.3.45.parm
+else if (${CONTFUNC} == "CEN") then
+  setenv SIDEP ${DD}/cen.parm
+else if (${CONTFUNC} == "ODC") then
+  setenv SIDEP ${DD}/odc.parm
+else if (${CONTFUNC} != "SIG") then
+  echo "Unknown sidechain contact function ${CONTFUNC}"
+  exit
+endif
+
+limit coredumpsize 0
+$BIN/zscorezMD_sccor-T-sig-split $*

diff --git a/source/ga/input-templates/galera/start_all.pbs b/source/ga/input-templates/galera/start_all.pbs
new file mode 100755 (executable)
index 0000000..314b306
--- /dev/null
+++ b/source/ga/input-templates/galera/start_all.pbs
@@ -0,0 +1,25 @@
+#PBS -N single-run
+#PBS -q batch
+#PBS -l nodes=32:ppn=8
+#PBS -l walltime=0:30:00
+
+cd $PBS_O_WORKDIR
+
+rm nody
+cat $PBS_NODEFILE |uniq > nody
+
+./unresga
+
+time /opt/mpi/mvapich/bin/mpirun_pbs ./unres.csh
+
+time /opt/mpi/mvapich/bin/mpirun -machinefile nodes -np 16 wham.csh
+
+time /opt/mpi/mvapich/bin/mpirun -machinefile nodes -np 16 opt.csh
+
+
+set DATA=`date +%Y-%m-%d-%H%M%S`
+mkdir ceiksy-$DATA
+mv *.cx ceiksy-$DATA
+
+
+mail -s "Galera - wyniki dla single_run sa dostepne" lightnir@gmail.com

diff --git a/source/ga/input-templates/galera/unres.csh b/source/ga/input-templates/galera/unres.csh
new file mode 100755 (executable)
index 0000000..f9a8afa
--- /dev/null
+++ b/source/ga/input-templates/galera/unres.csh
@@ -0,0 +1,26 @@
+#!/bin/csh -f
+
+set DD = /users/kdm/lightnir/PARAM
+#-----------------------------------------------------------------------------
+setenv FGPROCS 0
+setenv POT GB
+setenv PREFIX 1LE1_mremd
+setenv OUT1FILE Y
+#-----------------------------------------------------------------------------
+setenv UNRES_BIN /users/kdm/czarek/UNRES/NEW/bin/unres_Tc_procor_new_em64_hremd_mpich1.exe
+#-----------------------------------------------------------------------------
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+setenv PATTERN $DD/patterns.cart
+#-----------------------------------------------------------------------------
+
+$UNRES_BIN $*
+

diff --git a/source/ga/input-templates/galera/unresga.inp b/source/ga/input-templates/galera/unresga.inp
new file mode 100644 (file)
index 0000000..7d4dd80
--- /dev/null
+++ b/source/ga/input-templates/galera/unresga.inp
@@ -0,0 +1,7 @@
+pdb=1LE1.pdb
+alg=csa
+generations=1
+cicutoff=5.0
+population=4
+whamtemplate=1LE1_wham.tpl
+mremdtemplate=1LE1_mremd.tpl

diff --git a/source/ga/input-templates/galera/wham.csh b/source/ga/input-templates/galera/wham.csh
new file mode 100755 (executable)
index 0000000..6047264
--- /dev/null
+++ b/source/ga/input-templates/galera/wham.csh
@@ -0,0 +1,67 @@
+#!/bin/csh -f
+#set echo
+# Script to run the program zscorezi_MPI on linux with MPICH (parallel version).
+#
+echo "This job is running on host `hostname` "
+
+set DD =  /users/kdm/lightnir/PARAM
+set BIN = /users/kdm/adaml/UNRES/bin
+
+set POT = GB
+setenv POT GB
+
+setenv SCRATCHDIR /tmp/`whoami`
+
+#
+# Przygotowanie i wyczyszczenie poletka 
+#
+if ( ! -d $SCRATCHDIR ) then
+ mkdir $SCRATCHDIR
+endif
+rm -f $SCRATCHDIR/*
+
+setenv PREFIX 1LE1_wham
+
+#
+# Is the specified potential in the list of valid force fields?
+#
+if (($POT != "LJ") && ($POT != "LJK") && ($POT != "BP") && ($POT != "GB") \
+&& ($POT != "GBV") ) then
+  echo "Unknown potential type $POT"
+  exit(1)
+endif
+
+# 5/17/97 parameter file assignment was changed from link to SETENV statements
+#
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+setenv PATTERN $DD/patterns.cart
+# Define contact function for classification
+setenv CONTFUNC GB
+if (${CONTFUNC} == "GB") then
+  setenv SIDEP ${DD}/contact.3.parm
+else if (${CONTFUNC} == "SCDIST") then
+  setenv SIDEP ${DD}/cend.3.45.parm
+else if (${CONTFUNC} == "CEN") then
+  setenv SIDEP ${DD}/cen.parm
+else if (${CONTFUNC} == "ODC") then
+  setenv SIDEP ${DD}/odc.parm
+else if (${CONTFUNC} != "SIG") then
+  echo "Unknown sidechain contact function ${CONTFUNC}"
+  exit
+endif
+
+# Set parallel environment, depending on job type (interactive or batch).
+
+set DEBUG = 0
+
+limit coredumpsize 0
+$BIN/wham_multparm-hamrep-sep $*

diff --git a/source/ga/input-templates/galera/zscore.tpl b/source/ga/input-templates/galera/zscore.tpl
new file mode 100644 (file)
index 0000000..851dc82
--- /dev/null
+++ b/source/ga/input-templates/galera/zscore.tpl
@@ -0,0 +1,82 @@
+iseed=3269 n_ene=19 nparmset={POPSIZE} out_newe
+mask_sc=0 mask_scp=1 mask_elec=1 mask_ang=1 mask_scloc=1 mask_tor=1            &
+mask_tord=1 mask_corrh=1 mask_corr5=0 mask_corr6=0 mask_el_loc=1               &
+mask_turn3=1 mask_turn4=1 mask_turn6=0 mask_vdwpp=1 mask_sccor=1
+wlow_sc=0.8 wlow_scp=0.0 wlow_elec=0.00 wlow_ang=0.00 wlow_scloc=0.00          &
+wlow_tor=0.0 wlow_tord=0.0 wlow_corrh=0.00 wlow_corr5=0.00 wlow_corr6=0.00     &
+wlow_sccor=0.0                                                                 &
+wlow_el_loc=0.00 wlow_turn3=0.00 wlow_turn4=0.00 wlow_turn6=0.00 wlow_vdwpp=0.0 
+wup_sc=1.2 wup_scp=5.0 wup_elec=5.0 wup_ang=5.00 wup_scloc=5.0                 &
+wup_tor=5.0 wup_tord=5.0 wup_corrh=5.0 wup_corr5=5.0 wup_corr6=5.0             &
+wup_el_loc=5.0 wup_turn3=5.0  wup_turn4=5.0 wup_turn6=5.0 wup_vdwpp=5.0        &
+wup_sccor=0.0
+mode=3 maxmin=10  maxfun=2000 opt_mode=0 tolf=1.0E-4 rtolf=1.0E-4 out_minim    &
+print_ini print_fin print_stat optimize_other read_stat=4 minimizer=sumsl      &
+rescale_mode=2
+mod_side
+end
+mod_fourier
+end
+mod_elec
+end
+mod_scp
+end
+{WEIGHTS}
+nprot=1
+{PREFIX01}
+rmscut=2.0 rmscut_gap=2.0 rkt=0.01 0.01 dkt=0.01 enecut=10000 enecut_min=10000 &
+enecut_max=20000 nbatch=1 nclass=2 nlevel=1
+id=coil nelem=1 mask=*.0.*
+id=native nelem=1  mask=*.1.*
+ngap_read=1 nT=13 beta=270 270 280 280 290 290 300 300 310 310 320 320 330 330 &
+340 340 345 345 350 350 360 360 370 370 380 380                                &
+hefac=10000 htfac=10000 helow=0 htlow=0
+nlev1=1 nlev2=1 level1=native level2=coil
+enegap=-2.0 -0.6   ewall=0.01                   !270
+enegap=-2.0 -0.6   ewall=0.01                   !280
+enegap=-2.0 -0.6   ewall=0.01                   !290
+enegap=-2.0 -0.6   ewall=0.01                   !300
+enegap=-2.0 -0.6   ewall=0.01                   !310
+enegap=-2.0 -0.6   ewall=0.01                   !320
+enegap=-2.0 -0.6   ewall=0.01                   !330
+enegap=-2.0 -0.6   ewall=0.01                   !340
+enegap=-0.5 0.5    ewall=0.01                   !345
+enegap=0.5 5.0     ewall=0.01                   !350
+enegap=0.5 5.0     ewall=0.01                   !360
+enegap=0.5 5.0     ewall=0.01                   !370
+enegap=0.5 5.0     ewall=0.01                   !380
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !270
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !280
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !290
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !300
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !310
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !320
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !330
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !340
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !345
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !350
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !360
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !370
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !380
+./{PARAM01}
+nres=14 one_letter
+XSWTWENGKWTWKX
+ 0
+PDBREF CAONLY SPLIT_BET=0 print_class nfrag=1
+CUTOFF_UP=6.0  CUTOFF_LOW=6.0  RMSUP_LIM=6.0  RMSUPUP_LIM=6.0  NFRAG=1         &
+FRAC_SEC=0.3
+npiece=1 n_shift1=3 n_shift2=3 rms=1 qcut=0.40 qwol=1 local=0 angcut=60.0      &
+elcont=0 sccont=0
+ifrag1=2  ifrag2=13
+./{PREFIX01}.pdb
+read_weights=1
+batch=1 class=all                                                              &
+qlow=0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.60 0.70 0.70 0.70          &
+ qup=0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.90 0.90 0.90 0.90 0.90          &
+wq=1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10       &
+1.0d10 1.0d10 1.0d10
+end
+nthehel=25 ngahel=40 the0hel=70 dthehel=2 ga0hel=-100                          &
+nrbet=15 r0bet=3.0 nthebet=50 the0bet=60 dthebet=2 phialpha=60.0 delr=15.0     &
+delb=4.0 PHIALPHA_RIGHT=47.0 PHIALPHA_LEFT=44.0
+NGRIDT=400 T0=200 DELTAT=1

diff --git a/source/ga/input-templates/matrix/1LE1_mremd.tpl b/source/ga/input-templates/matrix/1LE1_mremd.tpl
new file mode 100644 (file)
index 0000000..b36236a
--- /dev/null
+++ b/source/ga/input-templates/matrix/1LE1_mremd.tpl
@@ -0,0 +1,14 @@
+1LE1 random parameters #1
+SEED=-6086648 RE pdbref refstr ONE_LETTER  rescale_mode=2 out1file extconf
+nstep=2000000  ntwe=10000 ntwx=10000 lang=0 tbf t_bath=300 tau_bath=1.0        &
+dt=0.10 reset_moment=1000 reset_vel=10000 damax=4.0 
+nrep=16 nstex=10000 tlist mlist traj1file rest1file sync nsyn=10000 tonly      &
+hremd={POPSIZE}
+ 250 260 270 280 290 300 310 320 330 340 350 360 370 380 390 400
+   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1
+{WEIGHTS}
+{PREFIX}.pdb
+14
+XSWTWENGKWTWKX
+0
+0

diff --git a/source/ga/input-templates/matrix/1LE1_wham.tpl b/source/ga/input-templates/matrix/1LE1_wham.tpl
new file mode 100644 (file)
index 0000000..f68f1e3
--- /dev/null
+++ b/source/ga/input-templates/matrix/1LE1_wham.tpl
@@ -0,0 +1,46 @@
+SEED=-3059743 n_ene=19 isampl=1 nq=1 classify pdbref einicheck=1               &
+rescale=2 ensembles=0 nslice=1 HAMIL_REP oneletter cxfile separate_parset      &
+nparmset={POPSIZE}
+nres=14 one_letter
+XSWTWENGKWTWKX
+0
+{WEIGHTS}
+NT=16 replica
+NR=1 TEMP= 250.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 260.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 270.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 280.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 290.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 300.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 310.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 320.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 330.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 340.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 350.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 360.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 370.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 380.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 390.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 400.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+nfile_cx=1 rec_start=101   rec_end=200    totraj=256
+./{PREFIX}_mremd_MD000
+CUTOFF_UP=8.0 CUTOFF_LOW=4.0 NLEVEL=-2 PDBREF                                  &
+SPLIT_BET=1 NC_FRAC_HEL=0.7 NC_FRAC_BET=0.5 NC_FRAC_PAIR=0.5 NSHIFT_PAIR=3     &
+CONT_PAIR=1 NC_FRAC_PAIR=0.5 RMS_PAIR=0
+./{PREFIX}.pdb

diff --git a/source/ga/input-templates/matrix/opt.csh b/source/ga/input-templates/matrix/opt.csh
new file mode 100755 (executable)
index 0000000..f8f14b5
--- /dev/null
+++ b/source/ga/input-templates/matrix/opt.csh
@@ -0,0 +1,69 @@
+#!/bin/csh -f
+# Script to run the program zscorezi_MPI on linux with MPICH (parallel version).
+#
+
+echo "This job is running on host `hostname` "
+
+set DD =  /users/adam/UNRES/PARAM
+set BIN = /users/adam/ZSCOREZ/bin
+
+set POT = GB
+setenv POT GB
+
+setenv PREFIX zscore
+setenv SCRATCHDIR /tmp/`whoami`
+
+if ( ! -d $SCRATCHDIR ) then
+  mkdir $SCRATCHDIR 
+endif
+
+#hostname
+#ls -l /tmp
+
+#
+# Is the specified potential in the list of valid force fields?
+#
+if (($POT != "LJ") && ($POT != "LJK") && ($POT != "BP") && ($POT != "GB") \
+&& ($POT != "GBV") ) then
+  echo "Unknown potential type $POT"
+  exit(1)
+endif
+
+# 5/17/97 parameter file assignment was changed from link to SETENV statements
+#
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+#setenv BONDPAR $DD/bond.parm
+#setenv THETPAR $DD/thetaml.5parm
+#setenv ROTPAR $DD/scgauss.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+
+# Set parallel environment, depending on job type (interactive or batch).
+
+set DEBUG = 0
+
+# Choose the sidechain contact function
+
+setenv CONTFUNC GB
+if (${CONTFUNC} == "GB") then
+  setenv SIDEP ${DD}/contact.3.parm
+else if (${CONTFUNC} == "SCDIST") then
+  setenv SIDEP ${DD}/cend.3.45.parm
+else if (${CONTFUNC} == "CEN") then
+  setenv SIDEP ${DD}/cen.parm
+else if (${CONTFUNC} == "ODC") then
+  setenv SIDEP ${DD}/odc.parm
+else if (${CONTFUNC} != "SIG") then
+  echo "Unknown sidechain contact function ${CONTFUNC}"
+  exit
+endif
+
+limit coredumpsize 0
+$BIN/zscorezMD_sccor-T-OPTERON-clust-sign-split $*

diff --git a/source/ga/input-templates/matrix/start_all.pbs b/source/ga/input-templates/matrix/start_all.pbs
new file mode 100755 (executable)
index 0000000..83d4130
--- /dev/null
+++ b/source/ga/input-templates/matrix/start_all.pbs
@@ -0,0 +1,25 @@
+#PBS -N single-test
+#PBS -q dque
+#PBS -l nodes=32:ppn=8
+#PBS -l walltime=1:00:00
+
+set NPROCS=`cat $PBS_NODEFILE | wc -l`
+
+cd $PBS_O_WORKDIR
+
+./unresga
+
+cat $PBS_NODEFILE|uniq > nody
+
+time /users/software/mpich_ssh/bin/mpirun -machinefile $PBS_NODEFILE -np $NPROCS -p4wd $PBS_O_WORKDIR  $PBS_O_WORKDIR/unres.csh
+
+time /users/software/mpich_ssh/bin/mpirun -machinefile $PBS_NODEFILE -np 16 -p4wd $PBS_O_WORKDIR  $PBS_O_WORKDIR/wham.csh
+
+time /users/software/mpich_ssh/bin/mpirun -machinefile $PBS_NODEFILE -np 16 ./opt.csh
+
+set DATA=`date +%Y-%m-%d-%H%M%S`
+mkdir ceiksy-$DATA
+mv *.cx ceiksy-$DATA
+
+#mail -s "Scheraga - wyniki dla single-test sa dostepne" lightnir@gmail.com
+

diff --git a/source/ga/input-templates/matrix/unres.csh b/source/ga/input-templates/matrix/unres.csh
new file mode 100755 (executable)
index 0000000..5d5fc95
--- /dev/null
+++ b/source/ga/input-templates/matrix/unres.csh
@@ -0,0 +1,26 @@
+#!/bin/csh -f
+
+set DD = /users/czarek/UNRES/PARAM
+#-----------------------------------------------------------------------------
+setenv FGPROCS 0
+setenv POT GB
+setenv PREFIX 1LE1_mremd
+setenv OUT1FILE Y
+#-----------------------------------------------------------------------------
+setenv UNRES_BIN /users/czarek/UNRES/NEW/bin/unres_Tc_procor_new_em64_nh_hremd.exe
+#-----------------------------------------------------------------------------
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+setenv PATTERN $DD/patterns.cart
+#-----------------------------------------------------------------------------
+
+$UNRES_BIN $*
+

diff --git a/source/ga/input-templates/matrix/unresga.inp b/source/ga/input-templates/matrix/unresga.inp
new file mode 100644 (file)
index 0000000..a4e74ce
--- /dev/null
+++ b/source/ga/input-templates/matrix/unresga.inp
@@ -0,0 +1,7 @@
+pdb=1LE1.pdb
+alg=csa
+generations=5
+cicutoff=0.01
+population=8
+whamtemplate=1LE1_wham.tpl
+mremdtemplate=1LE1_mremd.tpl

diff --git a/source/ga/input-templates/matrix/wham.csh b/source/ga/input-templates/matrix/wham.csh
new file mode 100755 (executable)
index 0000000..e8fcddc
--- /dev/null
+++ b/source/ga/input-templates/matrix/wham.csh
@@ -0,0 +1,66 @@
+#!/bin/csh -f
+#set echo
+# Script to run the program zscorezi_MPI on linux with MPICH (parallel version).
+#
+echo "This job is running on host `hostname` "
+
+set DD =  /users/adam/UNRES/PARAM
+set BIN = /users/adam/ZSCOREZ/bin
+
+set POT = GB
+setenv POT GB
+setenv SCRATCHDIR /tmp/`whoami`
+
+#
+# Przygotowanie i wyczyszczenie poletka 
+#
+if ( ! -d $SCRATCHDIR ) then
+ mkdir $SCRATCHDIR
+endif
+rm -f $SCRATCHDIR/*
+
+setenv PREFIX 1LE1_wham
+
+#
+# Is the specified potential in the list of valid force fields?
+#
+if (($POT != "LJ") && ($POT != "LJK") && ($POT != "BP") && ($POT != "GB") \
+&& ($POT != "GBV") ) then
+  echo "Unknown potential type $POT"
+  exit(1)
+endif
+
+# 5/17/97 parameter file assignment was changed from link to SETENV statements
+#
+setenv BONDPAR $DD/bond_AM1.parm
+setenv THETPAR $DD/theta_abinitio.parm
+setenv ROTPAR $DD/rotamers_AM1_aura.10022007.parm
+setenv TORPAR $DD/torsion_631Gdp.parm
+setenv TORDPAR $DD/torsion_double_631Gdp.parm
+setenv ELEPAR $DD/electr_631Gdp.parm
+setenv SIDEPAR $DD/scinter_${POT}.parm
+setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
+setenv SCPPAR $DD/scp.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
+setenv PATTERN $DD/patterns.cart
+# Define contact function for classification
+setenv CONTFUNC GB
+if (${CONTFUNC} == "GB") then
+  setenv SIDEP ${DD}/contact.3.parm
+else if (${CONTFUNC} == "SCDIST") then
+  setenv SIDEP ${DD}/cend.3.45.parm
+else if (${CONTFUNC} == "CEN") then
+  setenv SIDEP ${DD}/cen.parm
+else if (${CONTFUNC} == "ODC") then
+  setenv SIDEP ${DD}/odc.parm
+else if (${CONTFUNC} != "SIG") then
+  echo "Unknown sidechain contact function ${CONTFUNC}"
+  exit
+endif
+
+# Set parallel environment, depending on job type (interactive or batch).
+
+set DEBUG = 0
+
+limit coredumpsize 0
+$BIN/wham_multparm-hamrep-sep $*

diff --git a/source/ga/input-templates/matrix/zscore.tpl b/source/ga/input-templates/matrix/zscore.tpl
new file mode 100644 (file)
index 0000000..851dc82
--- /dev/null
+++ b/source/ga/input-templates/matrix/zscore.tpl
@@ -0,0 +1,82 @@
+iseed=3269 n_ene=19 nparmset={POPSIZE} out_newe
+mask_sc=0 mask_scp=1 mask_elec=1 mask_ang=1 mask_scloc=1 mask_tor=1            &
+mask_tord=1 mask_corrh=1 mask_corr5=0 mask_corr6=0 mask_el_loc=1               &
+mask_turn3=1 mask_turn4=1 mask_turn6=0 mask_vdwpp=1 mask_sccor=1
+wlow_sc=0.8 wlow_scp=0.0 wlow_elec=0.00 wlow_ang=0.00 wlow_scloc=0.00          &
+wlow_tor=0.0 wlow_tord=0.0 wlow_corrh=0.00 wlow_corr5=0.00 wlow_corr6=0.00     &
+wlow_sccor=0.0                                                                 &
+wlow_el_loc=0.00 wlow_turn3=0.00 wlow_turn4=0.00 wlow_turn6=0.00 wlow_vdwpp=0.0 
+wup_sc=1.2 wup_scp=5.0 wup_elec=5.0 wup_ang=5.00 wup_scloc=5.0                 &
+wup_tor=5.0 wup_tord=5.0 wup_corrh=5.0 wup_corr5=5.0 wup_corr6=5.0             &
+wup_el_loc=5.0 wup_turn3=5.0  wup_turn4=5.0 wup_turn6=5.0 wup_vdwpp=5.0        &
+wup_sccor=0.0
+mode=3 maxmin=10  maxfun=2000 opt_mode=0 tolf=1.0E-4 rtolf=1.0E-4 out_minim    &
+print_ini print_fin print_stat optimize_other read_stat=4 minimizer=sumsl      &
+rescale_mode=2
+mod_side
+end
+mod_fourier
+end
+mod_elec
+end
+mod_scp
+end
+{WEIGHTS}
+nprot=1
+{PREFIX01}
+rmscut=2.0 rmscut_gap=2.0 rkt=0.01 0.01 dkt=0.01 enecut=10000 enecut_min=10000 &
+enecut_max=20000 nbatch=1 nclass=2 nlevel=1
+id=coil nelem=1 mask=*.0.*
+id=native nelem=1  mask=*.1.*
+ngap_read=1 nT=13 beta=270 270 280 280 290 290 300 300 310 310 320 320 330 330 &
+340 340 345 345 350 350 360 360 370 370 380 380                                &
+hefac=10000 htfac=10000 helow=0 htlow=0
+nlev1=1 nlev2=1 level1=native level2=coil
+enegap=-2.0 -0.6   ewall=0.01                   !270
+enegap=-2.0 -0.6   ewall=0.01                   !280
+enegap=-2.0 -0.6   ewall=0.01                   !290
+enegap=-2.0 -0.6   ewall=0.01                   !300
+enegap=-2.0 -0.6   ewall=0.01                   !310
+enegap=-2.0 -0.6   ewall=0.01                   !320
+enegap=-2.0 -0.6   ewall=0.01                   !330
+enegap=-2.0 -0.6   ewall=0.01                   !340
+enegap=-0.5 0.5    ewall=0.01                   !345
+enegap=0.5 5.0     ewall=0.01                   !350
+enegap=0.5 5.0     ewall=0.01                   !360
+enegap=0.5 5.0     ewall=0.01                   !370
+enegap=0.5 5.0     ewall=0.01                   !380
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !270
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !280
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !290
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !300
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !310
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !320
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !330
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !340
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !345
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !350
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !360
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !370
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !380
+./{PARAM01}
+nres=14 one_letter
+XSWTWENGKWTWKX
+ 0
+PDBREF CAONLY SPLIT_BET=0 print_class nfrag=1
+CUTOFF_UP=6.0  CUTOFF_LOW=6.0  RMSUP_LIM=6.0  RMSUPUP_LIM=6.0  NFRAG=1         &
+FRAC_SEC=0.3
+npiece=1 n_shift1=3 n_shift2=3 rms=1 qcut=0.40 qwol=1 local=0 angcut=60.0      &
+elcont=0 sccont=0
+ifrag1=2  ifrag2=13
+./{PREFIX01}.pdb
+read_weights=1
+batch=1 class=all                                                              &
+qlow=0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.60 0.70 0.70 0.70          &
+ qup=0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.90 0.90 0.90 0.90 0.90          &
+wq=1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10       &
+1.0d10 1.0d10 1.0d10
+end
+nthehel=25 ngahel=40 the0hel=70 dthehel=2 ga0hel=-100                          &
+nrbet=15 r0bet=3.0 nthebet=50 the0bet=60 dthebet=2 phialpha=60.0 delr=15.0     &
+delb=4.0 PHIALPHA_RIGHT=47.0 PHIALPHA_LEFT=44.0
+NGRIDT=400 T0=200 DELTAT=1

diff --git a/source/ga/input-templates/piasek/1L2Y_mremd.tpl b/source/ga/input-templates/piasek/1L2Y_mremd.tpl
new file mode 100644 (file)
index 0000000..6eec1c8
--- /dev/null
+++ b/source/ga/input-templates/piasek/1L2Y_mremd.tpl
@@ -0,0 +1,13 @@
+1LE1 random parameters #1
+SEED=-6086648 RE pdbref refstr ONE_LETTER  rescale_mode=2 out1file extconf
+nstep=5000000  ntwe=10000 ntwx=10000 lang=0 tbf t_bath=300 tau_bath=1.0        &
+dt=0.10 reset_moment=1000 reset_vel=10000 damax=4.0
+nrep=20 nstex=10000 tlist mlist traj1file rest1file sync nsyn=10000 hremd={POPSIZE} tonly
+ 250 260 270 280 290 300 310 320 330 340 350 360 370 380 390 400 420 440 460 500
+   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1
+{WEIGHTS}
+{PREFIX}.pdb
+14
+XSWTWENGKWTWKX
+0
+0

diff --git a/source/ga/input-templates/piasek/1L2Y_wham.tpl b/source/ga/input-templates/piasek/1L2Y_wham.tpl
new file mode 100644 (file)
index 0000000..9ccdb3e
--- /dev/null
+++ b/source/ga/input-templates/piasek/1L2Y_wham.tpl
@@ -0,0 +1,53 @@
+SEED=-3059743 n_ene=19 isampl=1  nparmset=1 nq=1 classify pdbref einicheck=1   &
+rescale=2 ensembles=1 cxfile nslice=5 
+nres=14 one_letter
+XSWTWENGKWTWKX
+0
+{WEIGHTS}
+NT=20 replica umbrella
+NR=1 TEMP= 250.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 260.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 270.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 280.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 290.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 300.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 310.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 320.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 330.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 340.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 350.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 360.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 370.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 380.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 390.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 400.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 420.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 440.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 460.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 500.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+nfile_cx=1 rec_start=1   rec_end=500    totraj=20
+../{PREFIX}_MD000
+CUTOFF_UP=8.0 CUTOFF_LOW=4.0 NLEVEL=-2 PDBREF                                  &
+SPLIT_BET=1 NC_FRAC_HEL=0.7 NC_FRAC_BET=0.5 NC_FRAC_PAIR=0.5 NSHIFT_PAIR=3     &
+CONT_PAIR=1 NC_FRAC_PAIR=0.5 RMS_PAIR=0
+../{PREFIX}.pdb

diff --git a/source/ga/input-templates/piasek/1LE1_mremd.tpl b/source/ga/input-templates/piasek/1LE1_mremd.tpl
new file mode 100644 (file)
index 0000000..6eec1c8
--- /dev/null
+++ b/source/ga/input-templates/piasek/1LE1_mremd.tpl
@@ -0,0 +1,13 @@
+1LE1 random parameters #1
+SEED=-6086648 RE pdbref refstr ONE_LETTER  rescale_mode=2 out1file extconf
+nstep=5000000  ntwe=10000 ntwx=10000 lang=0 tbf t_bath=300 tau_bath=1.0        &
+dt=0.10 reset_moment=1000 reset_vel=10000 damax=4.0
+nrep=20 nstex=10000 tlist mlist traj1file rest1file sync nsyn=10000 hremd={POPSIZE} tonly
+ 250 260 270 280 290 300 310 320 330 340 350 360 370 380 390 400 420 440 460 500
+   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1   1
+{WEIGHTS}
+{PREFIX}.pdb
+14
+XSWTWENGKWTWKX
+0
+0

diff --git a/source/ga/input-templates/piasek/1LE1_wham.tpl b/source/ga/input-templates/piasek/1LE1_wham.tpl
new file mode 100644 (file)
index 0000000..9ccdb3e
--- /dev/null
+++ b/source/ga/input-templates/piasek/1LE1_wham.tpl
@@ -0,0 +1,53 @@
+SEED=-3059743 n_ene=19 isampl=1  nparmset=1 nq=1 classify pdbref einicheck=1   &
+rescale=2 ensembles=1 cxfile nslice=5 
+nres=14 one_letter
+XSWTWENGKWTWKX
+0
+{WEIGHTS}
+NT=20 replica umbrella
+NR=1 TEMP= 250.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 260.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 270.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 280.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 290.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 300.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 310.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 320.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 330.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 340.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 350.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 360.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 370.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 380.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 390.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 400.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 420.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 440.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 460.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+NR=1 TEMP= 500.0 FI=  0.00000   0.00000   0.00000   0.00000   0.00000
+KH=   0.00 Q0=0.00000
+nfile_cx=1 rec_start=1   rec_end=500    totraj=20
+../{PREFIX}_MD000
+CUTOFF_UP=8.0 CUTOFF_LOW=4.0 NLEVEL=-2 PDBREF                                  &
+SPLIT_BET=1 NC_FRAC_HEL=0.7 NC_FRAC_BET=0.5 NC_FRAC_PAIR=0.5 NSHIFT_PAIR=3     &
+CONT_PAIR=1 NC_FRAC_PAIR=0.5 RMS_PAIR=0
+../{PREFIX}.pdb

diff --git a/source/ga/input-templates/piasek/startmremd.mat b/source/ga/input-templates/piasek/startmremd.mat
new file mode 100755 (executable)
index 0000000..e732ddc
--- /dev/null
+++ b/source/ga/input-templates/piasek/startmremd.mat
@@ -0,0 +1,11 @@
+#PBS -N {JOBNAME}
+#PBS -q special
+#PBS -l nodes=5:quad:core2:ppn=4
+
+set NPROCS=`cat $PBS_NODEFILE | wc -l`
+
+echo $NPROCS processors used
+
+time mpirun -machinefile $PBS_NODEFILE -np $NPROCS -nolocal -p4wd $PBS_O_WORKDIR \
+$PBS_O_WORKDIR/unres.csh
+

diff --git a/source/ga/input-templates/piasek/startwham.mat b/source/ga/input-templates/piasek/startwham.mat
new file mode 100755 (executable)
index 0000000..425960c
--- /dev/null
+++ b/source/ga/input-templates/piasek/startwham.mat
@@ -0,0 +1,10 @@
+#PBS -N {JOBNAME}
+#PBS -q special
+#PBS -l nodes=1:core2:ppn=4
+
+set NPROCS=`cat $PBS_NODEFILE | wc -l`
+
+echo $NPROCS processors used
+
+time mpirun -machinefile $PBS_NODEFILE -np 1 -p4wd $PBS_O_WORKDIR \
+$PBS_O_WORKDIR/wham.csh

diff --git a/source/ga/input-templates/piasek/unresga.inp b/source/ga/input-templates/piasek/unresga.inp
new file mode 100644 (file)
index 0000000..65329f6
--- /dev/null
+++ b/source/ga/input-templates/piasek/unresga.inp
@@ -0,0 +1,8 @@
+pdb=1LE1.pdb 1L2Y.pdb
+alg=csa
+generations=50
+cicutoff=5.0
+population=4
+whamtemplate=1LE1_wham.tpl 1L2Y_wham.tpl
+mremdtemplate=1LE1_mremd.tpl 1L2Y_mremd.tpl
+scripts=startwham.mat startmremd.mat

diff --git a/source/ga/input-templates/piasek/zscore.tpl b/source/ga/input-templates/piasek/zscore.tpl
new file mode 100644 (file)
index 0000000..a424f8a
--- /dev/null
+++ b/source/ga/input-templates/piasek/zscore.tpl
@@ -0,0 +1,135 @@
+iseed=3269 n_ene=19 nparmset={POPSIZE} out_newe
+mask_sc=0 mask_scp=1 mask_elec=1 mask_ang=1 mask_scloc=1 mask_tor=1            &
+mask_tord=1 mask_corrh=1 mask_corr5=0 mask_corr6=0 mask_el_loc=1               &
+mask_turn3=1 mask_turn4=1 mask_turn6=0 mask_vdwpp=1 mask_sccor=1
+wlow_sc=0.8 wlow_scp=0.0 wlow_elec=0.00 wlow_ang=0.00 wlow_scloc=0.00          &
+wlow_tor=0.0 wlow_tord=0.0 wlow_corrh=0.00 wlow_corr5=0.00 wlow_corr6=0.00     &
+wlow_sccor=0.0                                                                 &
+wlow_el_loc=0.00 wlow_turn3=0.00 wlow_turn4=0.00 wlow_turn6=0.00 wlow_vdwpp=0.0 
+wup_sc=1.2 wup_scp=5.0 wup_elec=5.0 wup_ang=5.00 wup_scloc=5.0                 &
+wup_tor=5.0 wup_tord=5.0 wup_corrh=5.0 wup_corr5=5.0 wup_corr6=5.0             &
+wup_el_loc=5.0 wup_turn3=5.0  wup_turn4=5.0 wup_turn6=5.0 wup_vdwpp=5.0        &
+wup_sccor=0.0
+mode=3 maxfun=2000 opt_mode=0 tolf=1.0E-4 rtolf=1.0E-4 out_minim               &
+print_ini print_fin print_stat optimize_other read_stat=4 minimizer=sumsl      &
+rescale_mode=2 maxmin={MAXMIN}
+mod_side
+end
+mod_fourier
+end
+mod_elec
+end
+mod_scp
+end
+{WEIGHTS}
+nprot=2
+{PREFIX01}
+rmscut=2.0 rmscut_gap=2.0 rkt=0.01 0.01 dkt=0.01 enecut=10000 enecut_min=10000 &
+enecut_max=20000 nbatch=1 nclass=2 nlevel=1
+id=coil nelem=1 mask=*.0.*
+id=native nelem=1  mask=*.1.*
+ngap_read=1 nT=13 beta=270 270 280 280 290 290 300 300 310 310 320 320 330 330 &
+340 340 345 345 350 350 360 360 370 370 380 380                                &
+hefac=10000 htfac=10000 helow=0 htlow=0
+nlev1=1 nlev2=1 level1=native level2=coil
+enegap=-2.0 -0.6   ewall=0.01                   !270
+enegap=-2.0 -0.6   ewall=0.01                   !280
+enegap=-2.0 -0.6   ewall=0.01                   !290
+enegap=-2.0 -0.6   ewall=0.01                   !300
+enegap=-2.0 -0.6   ewall=0.01                   !310
+enegap=-2.0 -0.6   ewall=0.01                   !320
+enegap=-2.0 -0.6   ewall=0.01                   !330
+enegap=-2.0 -0.6   ewall=0.01                   !340
+enegap=-0.5 0.5    ewall=0.01                   !345
+enegap=0.5 5.0     ewall=0.01                   !350
+enegap=0.5 5.0     ewall=0.01                   !360
+enegap=0.5 5.0     ewall=0.01                   !370
+enegap=0.5 5.0     ewall=0.01                   !380
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !270
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !280
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !290
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !300
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !310
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !320
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !330
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !340
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !345
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !350
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !360
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !370
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !380
+{PARAM01}
+nres=14 one_letter
+XSWTWENGKWTWKX
+ 0
+PDBREF CAONLY SPLIT_BET=0 print_class nfrag=1
+CUTOFF_UP=6.0  CUTOFF_LOW=6.0  RMSUP_LIM=6.0  RMSUPUP_LIM=6.0  NFRAG=1         &
+FRAC_SEC=0.3
+npiece=1 n_shift1=3 n_shift2=3 rms=1 qcut=0.45 qwol=1 local=0 angcut=60.0      &
+elcont=0 sccont=0
+ifrag1=2  ifrag2=13
+./{PREFIX01}.pdb
+read_weights=1
+batch=1 class=all                                                              &
+qlow=0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.60 0.70 0.70 0.70          &
+ qup=0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.90 0.90 0.90 0.90 0.90          &
+wq=1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10       &
+1.0d10 1.0d10 1.0d10
+end
+{PREFIX02}
+rmscut=2.0 rmscut_gap=2.0 rkt=0.01 0.01 dkt=0.01 enecut=10000 enecut_min=10000 &
+enecut_max=20000 nbatch=1 nclass=2 nlevel=1
+id=coil nelem=1 mask=*.0.*
+id=native nelem=1  mask=*.1.*
+ngap_read=1 nT=13 beta=270 270 280 280 290 290 300 300 310 310 320 320 330 330 &
+340 340 345 345 350 350 360 360 370 370 380 380                                &
+hefac=10000 htfac=10000 helow=0 htlow=0
+nlev1=1 nlev2=1 level1=native level2=coil
+enegap=-2.0 -0.6   ewall=0.01                   !270
+enegap=-2.0 -0.6   ewall=0.01                   !280
+enegap=-2.0 -0.6   ewall=0.01                   !290
+enegap=-2.0 -0.6   ewall=0.01                   !300
+enegap=-2.0 -0.6   ewall=0.01                   !310
+enegap=-2.0 -0.6   ewall=0.01                   !320
+enegap=-2.0 -0.6   ewall=0.01                   !330
+enegap=-2.0 -0.6   ewall=0.01                   !340
+enegap=-0.5 0.5    ewall=0.01                   !345
+enegap=0.5 5.0     ewall=0.01                   !350
+enegap=0.5 5.0     ewall=0.01                   !360
+enegap=0.5 5.0     ewall=0.01                   !370
+enegap=0.5 5.0     ewall=0.01                   !380
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !270
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !280
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !290
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !300
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !310
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !320
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !330
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !340
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !345
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !350
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !360
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !370
+entshanwall=3.0e9 1.0e5  3.0e9  3.0e9  3.0e9  !380
+{PARAM02}
+nres=14 one_letter
+XSWTWENGKWTWKX
+ 0
+PDBREF CAONLY SPLIT_BET=0 print_class nfrag=1
+CUTOFF_UP=6.0  CUTOFF_LOW=6.0  RMSUP_LIM=6.0  RMSUPUP_LIM=6.0  NFRAG=1         &
+FRAC_SEC=0.3
+npiece=1 n_shift1=3 n_shift2=3 rms=1 qcut=0.45 qwol=1 local=0 angcut=60.0      &
+elcont=0 sccont=0
+ifrag1=2  ifrag2=13
+./{PREFIX02}.pdb
+read_weights=1
+batch=1 class=all                                                              &
+qlow=0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.60 0.70 0.70 0.70          &
+ qup=0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.30 0.90 0.90 0.90 0.90 0.90          &
+wq=1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10 1.0d10       &
+1.0d10 1.0d10 1.0d10
+end
+nthehel=25 ngahel=40 the0hel=70 dthehel=2 ga0hel=-100                          &
+nrbet=15 r0bet=3.0 nthebet=50 the0bet=60 dthebet=2 phialpha=60.0 delr=15.0     &
+delb=4.0 PHIALPHA_RIGHT=47.0 PHIALPHA_LEFT=44.0
+NGRIDT=400 T0=200 DELTAT=1

diff --git a/source/ga/io.inc b/source/ga/io.inc
new file mode 100644 (file)
index 0000000..77604fa
--- /dev/null
+++ b/source/ga/io.inc
@@ -0,0 +1,33 @@
+c  -- I/O units
+      integer :: inp = 1
+      integer :: ow = 3
+      integer :: opopsum = 4
+      integer :: pdb = 5
+      integer :: olog = 6
+      integer :: iwham = 7
+      integer :: owham = 8
+      integer :: imremd = 9
+      integer :: omremd = 10
+      integer :: izscore = 11
+      integer :: ozscore = 12
+      integer :: iscript = 13
+      integer :: oscript = 14
+      integer :: ostate = 15
+      integer :: izsoptw = 16                           ! zscore optimized weights files 
+      integer :: izenergy = 17
+      integer :: iobank = 18
+
+c  -- I/O filenames 
+      character*20 :: owfn = "weights"       
+      character*20 :: inpfn = "unresga.inp"            ! Main input file 
+      character*20 :: ologfn = "unresga.log"           ! Log
+c      character*20 :: iwhamfn = "wham.tpl"            ! wham input template file
+      character*20 :: owhamfn = "wham.inp"             ! wham input file
+c      character*20 :: imremdfn = "mremd.tpl"          ! mremd input template file
+      character*20 :: omremdfn = "mremd.inp"                   ! mremd input file
+      character*20 :: izscorefn = "zscore.tpl"                 ! zscore input template file
+      character*20 :: ozscorefn = "zscore.inp"                 ! zscore input file 
+      character*20 :: opopsumfn = "population.summary"
+      character*20 :: ostatefn = "unresga.state"       ! unresga state file
+      character*20 :: izenergyfn = "zscore.out_par"     ! zscore generated output prefix
+      character*20 :: iobankfn = "unresga.bank"         ! csa bank file

diff --git a/source/ga/tester.sh b/source/ga/tester.sh
new file mode 100755 (executable)
index 0000000..8ac452f
--- /dev/null
+++ b/source/ga/tester.sh
@@ -0,0 +1,14 @@
+#!/bin/bash
+
+if [ -d build ]; then
+ echo "Clearing build directory "
+ rm -rf build/*
+fi
+make
+cd build
+cp -r ~/poligon/zero/* ./
+./unresga
+
+echo ""
+
+cat unresga.bank