examples/unres/CSA/GAB/CSA/global/unrestrained/reminimize/1l2y_remini.out_GB000

   1 --------------------------------------------------------------------------------
   2                               FILE ASSIGNMENT
   3 --------------------------------------------------------------------------------
   4  Input file                      : 1l2y_remini.inp
   5  Output file                     : 1l2y_remini.out_GB000
   6
   7  Sidechain potential file        :
   8  /users/czarek/UNRES/GIT/unres/PARAM/sc_GB_opt.1gab_3S_qclass5no310-shan2-sc-16-
   9  10-8k
  10  SCp potential file              : /users/czarek/UNRES/GIT/unres/PARAM/scp.parm
  11  Electrostatic potential file    :
  12  /users/czarek/UNRES/GIT/unres/PARAM/electr_631Gdp.parm
  13  Cumulant coefficient file       :
  14  /users/czarek/UNRES/GIT/unres/PARAM/fourier_opt.parm.1igd_hc_iter3_3
  15  Torsional parameter file        :
  16  /users/czarek/UNRES/GIT/unres/PARAM/torsion_631Gdp.parm
  17  Double torsional parameter file :
  18  /users/czarek/UNRES/GIT/unres/PARAM/torsion_double_631Gdp.parm
  19  SCCOR parameter file : /users/czarek/UNRES/GIT/unres/PARAM/rotcorr_AM1.parm
  20  Bond & inertia constant file    : /users/czarek/UNRES/GIT/unres/PARAM/bond.parm
  21  Bending parameter file          :
  22  /users/czarek/UNRES/GIT/unres/PARAM/thetaml.5parm
  23  Rotamer parameter file          :
  24  /users/czarek/UNRES/GIT/unres/PARAM/scgauss.parm
  25  Threading database              :
  26  /users/czarek/UNRES/GIT/unres/PARAM/patterns.cart
  27 --------------------------------------------------------------------------------
  28 ********************************************************************************
  29 United-residue force field calculation - parallel job.
  30 ********************************************************************************
  31  ### LAST MODIFIED  11/03/09 1:19PM by czarek
  32  ++++ Compile info ++++
  33  Version CSA and DFA only
  34
  35 Potential is GB , exponents are   6 12
  36
  37 Disulfide bridge parameters:
  38 S-S bridge energy:      -5.50
  39 d0cm:      3.78 akcm:     15.10
  40 akth:     11.00 akct:     12.00
  41 v1ss:     -1.08 v2ss:      7.61 v3ss:     13.70
  42  MPI: node=            0  iseed=               -3059742
  43  ran_num  0.273754117333397
  44 RMSDBC =        3.0
  45 RMSDBC1 =        0.5
  46 RMSDBC1MAX =        1.5
  47 DRMS    =        0.1
  48 RMSDBCM =        3.0
  49 Time limit (min):     960.0
  50  RESCALE_MODE           0
  51 Library  routine used to diagonalize matrices.
  52
  53 ********************************************************************************
  54                     Options in energy minimization:
  55 ********************************************************************************
  56 MaxMin: 2000 MaxFun: 3000MinMin: 2000 MinFun: 2000 TolF:   1.00000E-02 RTolF:   1.00000E-04
  57
  58 Energy-term weights (unscaled):
  59
  60 WSCC=     1.352790 (SC-SC)
  61 WSCP=     1.593040 (SC-p)
  62 WELEC=    0.715340 (p-p electr)
  63 WVDWPP=   0.113710 (p-p VDW)
  64 WBOND=    1.000000 (stretching)
  65 WANG=     1.138730 (bending)
  66 WSCLOC=   0.162580 (SC local)
  67 WTOR=     1.985990 (torsional)
  68 WTORD=    1.570690 (double torsional)
  69 WSTRAIN=  1.000000 (SS bridges & dist. cnstr.)
  70 WEL_LOC=  0.160360 (multi-body 3-rd order)
  71 WCORR4=   0.428870 (multi-body 4th order)
  72 WCORR5=   0.000000 (multi-body 5th order)
  73 WCORR6=   0.000000 (multi-body 6th order)
  74 WSCCOR=   0.000000 (back-scloc correlation)
  75 WTURN3=   1.687220 (turns, 3rd order)
  76 WTURN4=   0.662300 (turns, 4th order)
  77 WTURN6=   0.000000 (turns, 6th order)
  78 WDFA_D=   0.000000 (DFA, distance)
  79 WDFA_T=   0.000000 (DFA, torsional)
  80 WDFA_N=   0.000000 (DFA, number of neighbor)
  81 WDFA_B=   0.000000 (DFA, beta formation)
  82
  83 Hydrogen-bonding correlation between contact pairs of peptide groups
  84
  85 Scaling factor of 1,4 SC-p interactions:   0.400
  86 General scaling factor of SC-p interactions:   1.000
  87
  88 Energy-term weights (scaled):
  89
  90 WSCC=     1.352790 (SC-SC)
  91 WSCP=     1.593040 (SC-p)
  92 WELEC=    0.715340 (p-p electr)
  93 WVDWPP=   0.113710 (p-p VDW)
  94 WBOND=    1.000000 (stretching)
  95 WANG=     1.138730 (bending)
  96 WSCLOC=   0.162580 (SC local)
  97 WTOR=     1.985990 (torsional)
  98 WTORD=    1.570690 (double torsional)
  99 WSTRAIN=  1.000000 (SS bridges & dist. cnstr.)
 100 WEL_LOC=  0.160360 (multi-body 3-rd order)
 101 WCORR4=   0.428870 (multi-body 4th order)
 102 WCORR5=   0.000000 (multi-body 5th order)
 103 WCORR6=   0.000000 (multi-body 6th order)
 104 WSCCOR=   0.000000 (back-scloc correlatkion)
 105 WTURN3=   1.687220 (turns, 3rd order)
 106 WTURN4=   0.662300 (turns, 4th order)
 107 WTURN6=   0.000000 (turns, 6th order)
 108 WDFA_D=   0.000000 (DFA, distance)
 109 WDFA_T=   0.000000 (DFA, torsional)
 110 WDFA_N=   0.000000 (DFA, number of neighbor)
 111 WDFA_B=   0.000000 (DFA, beta formation)
 112  Reference temperature for weights calculation:   300.000000000000
 113  Parameters of the SS-bond potential:
 114  D0CM   3.78000000000000       AKCM   15.1000000000000       AKTH
 115    11.0000000000000       AKCT   12.0000000000000
 116  V1SS  -1.08000000000000       V2SS   7.61000000000000       V3SS
 117    13.7000000000000
 118  EBR  -5.50000000000000
 119 PDB data will be read from file 1l2y.pdb
 120  Nres:    21
 121 Backbone and SC coordinates as read from the PDB
 122   1 21  D    -9.841   4.399  -5.051       -9.841   4.399  -5.051
 123   2 14  ASN  -8.608   3.135  -1.618      -10.909   3.249  -2.846
 124   3  5  LEU  -4.923   4.002  -2.452       -4.502   6.849  -1.550
 125   4  8  TYR  -3.690   2.738   0.981       -1.959   3.143   3.797
 126   5  4  ILE  -5.857  -0.449   0.613       -7.910  -0.417   1.393
 127   6 13  GLN  -4.122  -1.167  -2.743       -5.540  -1.315  -5.233
 128   7  7  TRP  -0.716  -0.631  -0.993        1.727   0.440   1.450
 129   8  5  LEU  -1.641  -2.932   1.963       -2.262  -1.871   4.556
 130   9 19  LYS  -3.024  -5.791  -0.269       -3.820  -5.527  -3.146
 131  10 16  ASP   0.466  -6.016  -1.905        0.653  -5.125  -3.676
 132  11 10  GLY   2.060  -6.618   1.593        2.060  -6.618   1.593
 133  12 10  GLY   2.626  -2.967   2.723        2.626  -2.967   2.723
 134  13 20  PRO   6.333  -2.533   3.806        5.724  -2.372   5.058
 135  14 12  SER   7.049  -6.179   2.704        6.757  -6.938   3.675
 136  15 12  SER   6.389  -5.315  -1.015        5.245  -5.350  -1.546
 137  16 10  GLY   9.451  -3.116  -1.870        9.451  -3.116  -1.870
 138  17 18  ARG   7.289   0.084  -2.054        5.225  -1.826  -3.986
 139  18 20  PRO   6.782   3.088   0.345        7.458   3.741  -0.688
 140  19 20  PRO   3.287   4.031   1.686        4.025   4.206   2.856
 141  20 20  PRO   1.185   6.543  -0.353        0.358   5.421  -0.430
 142  21 12  SER   0.852  10.027   1.285        1.151  10.636   1.488
 143  22 21  D    -1.250  12.539  -0.754       -1.250  12.539  -0.754
 144 nsup= 20 nstart_sup=  2
 145  ITEL
 146            1          21           0
 147            2          14           1
 148            3           5           1
 149            4           8           1
 150            5           4           1
 151            6          13           1
 152            7           7           1
 153            8           5           1
 154            9          19           1
 155           10          16           1
 156           11          10           1
 157           12          10           2
 158           13          20           1
 159           14          12           1
 160           15          12           1
 161           16          10           1
 162           17          18           2
 163           18          20           2
 164           19          20           2
 165           20          20           1
 166           21          12           0
 167  ns=           0  iss:
 168 Boundaries in phi angle sampling:
 169 D      1    -180.0     180.0
 170 ASN    2    -180.0     180.0
 171 LEU    3    -180.0     180.0
 172 TYR    4    -180.0     180.0
 173 ILE    5    -180.0     180.0
 174 GLN    6    -180.0     180.0
 175 TRP    7    -180.0     180.0
 176 LEU    8    -180.0     180.0
 177 LYS    9    -180.0     180.0
 178 ASP   10    -180.0     180.0
 179 GLY   11    -180.0     180.0
 180 GLY   12    -180.0     180.0
 181 PRO   13    -180.0     180.0
 182 SER   14    -180.0     180.0
 183 SER   15    -180.0     180.0
 184 GLY   16    -180.0     180.0
 185 ARG   17    -180.0     180.0
 186 PRO   18    -180.0     180.0
 187 PRO   19    -180.0     180.0
 188 PRO   20    -180.0     180.0
 189 SER   21    -180.0     180.0
 190 D     22    -180.0     180.0
 191 nsup= 20
 192  nsup=          20  nstart_sup=           2  nstart_seq=           2
 193  NZ_START=           2  NZ_END=          21
 194  IZ_SC=           0
 195  Processor           0  CG group           0  absolute rank           0  nhpb
 196            0  link_start=           1  link_end           0
 197  Contact order:  0.337121212121212
 198  Shifting contacts:           2           2
 199            1  TRP            7  TYR            4
 200            2  LEU            8  TYR            4
 201            3  LYS            9  GLN            6
 202            4  GLY           12  TRP            7
 203            5  GLY           12  LEU            8
 204            6  SER           14  GLY           11
 205            7  SER           15  ASP           10
 206            8  SER           15  GLY           11
 207            9  PRO           19  TRP            7
 208           10  PRO           20  LEU            3
 209           11  PRO           20  TYR            4
 210           12  PRO           20  TRP            7
 211 intinname
 212 1l2y_csa_GB000.int
 213
 214 Geometry of the virtual chain.
 215   Res           d     Theta     Gamma       Dsc     Alpha      Beta
 216 D     1     0.000     0.000     0.000     0.000     0.000     0.000
 217 ASN   2     3.800     0.000     0.000     1.684    90.531  -178.452
 218 LEU   3     3.800    92.239     0.000     1.939   101.575   -78.530
 219 TYR   4     3.800    92.239  -180.000     2.484   163.195    -7.440
 220 ILE   5     3.800    90.357    45.849     1.776   148.228  -110.333
 221 GLN   6     3.800    89.090    55.194     2.240   164.593  -141.638
 222 TRP   7     3.800    88.657    49.396     2.605   123.650   -21.913
 223 LEU   8     3.800    93.032    48.298     1.939   156.202  -108.750
 224 LYS   9     3.800    94.826    46.843     2.541   106.974   -55.960
 225 ASP  10     3.800    87.966    59.623     1.709   153.447  -128.646
 226 GLY  11     3.800    89.908    56.679     0.000     0.000     0.000
 227 GLY  12     3.800   100.181   -87.304     0.000     0.000     0.000
 228 PRO  13     3.800   109.073  -127.499     1.345   101.771  -115.580
 229 SER  14     3.800    89.537     4.261     1.150   144.515  -129.218
 230 SER  15     3.800    91.815    66.108     1.150   161.047  -100.177
 231 GLY  16     3.800   101.784    70.140     0.000     0.000     0.000
 232 ARG  17     3.800    92.201  -108.949     3.020   139.846  -132.716
 233 PRO  18     3.800   133.225   103.824     1.345   115.610  -118.024
 234 PRO  19     3.800   121.502  -122.527     1.345   118.575  -122.417
 235 PRO  20     3.800   117.950   -90.285     1.345   118.959  -126.207
 236 SER  21     3.800   114.201  -108.328     1.150   128.925   -37.341
 237 D    22     3.800   114.201   180.000     0.000     0.000     0.000
 238
 239
 240 ********************************************************************************
 241                     Processor   0: end reading molecular data.
 242 ********************************************************************************
 243
 244
 245 Energy minimization of multiple conformations calculation.
 246
 247 Conformations will be energy-minimized.
 248 ********************************************************************************
 249
 250  Conformation #           1  read
 251  Conformation #           2  read
 252  Conformation #           3  read
 253  Conformation #           4  read
 254  Conformation #           5  read
 255  Conformation #           6  read
 256  Conformation #           7  read
 257
 258
 259  Conformation #           1  sumsl return code            4
 260
 261 Virtual-chain energies:
 262
 263 EVDW=     -5.277354E+01 WEIGHT=    1.352790D+00 (SC-SC)
 264 EVDW2=     4.508194E+01 WEIGHT=    1.593040D+00 (SC-p)
 265 EES=      -9.028195E+01 WEIGHT=    7.153400D-01 (p-p)
 266 EVDWPP=   -1.823418E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 267 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 268 EBE=      -3.853950E+01 WEIGHT=    1.138730D+00 (bending)
 269 ESC=       3.678532E+01 WEIGHT=    1.625800D-01 (SC local)
 270 ETORS=     9.535113E+00 WEIGHT=    1.985990D+00 (torsional)
 271 ETORSD=   -6.847777E-01 WEIGHT=    1.570690D+00 (double torsional)
 272 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 273 ECORR4=   -6.543204E+01 WEIGHT=    4.288700D-01 (multi-body)
 274 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 275 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 276 EELLO=    -3.344015E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
 277 ETURN3=    1.734097E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 278 ETURN4=   -4.504341E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 279 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 280 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 281 EDIHC=     0.000000E+00 (dihedral angle constraints)
 282 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 283 UCONST=     0.000000E+00 (Constraint energy)
 284 EDFAD=     5.491269-315 (DFA distance energy)
 285 EDFAT=     6.953158-310 (DFA torsion energy)
 286 EDFAN=     6.953158-310 (DFA NCa energy)
 287 EDFAB=     2.650815-317 (DFA Beta energy)
 288 ETOT=     -8.811500E+01 (total)
 289 RMS deviation from the reference structure:   4.330
 290  % of native contacts:  25.000
 291  % of nonnative contacts:  86.364
 292  contact order:   0.380
 293  TM-score with the reference structure:     0.28
 294  Conformation #           8  read
 295
 296
 297  Conformation #           2  sumsl return code            4
 298
 299 Virtual-chain energies:
 300
 301 EVDW=     -5.251962E+01 WEIGHT=    1.352790D+00 (SC-SC)
 302 EVDW2=     4.557509E+01 WEIGHT=    1.593040D+00 (SC-p)
 303 EES=      -8.190080E+01 WEIGHT=    7.153400D-01 (p-p)
 304 EVDWPP=   -3.790640E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 305 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 306 EBE=      -3.825219E+01 WEIGHT=    1.138730D+00 (bending)
 307 ESC=       3.402944E+01 WEIGHT=    1.625800D-01 (SC local)
 308 ETORS=     7.601050E+00 WEIGHT=    1.985990D+00 (torsional)
 309 ETORSD=   -8.209400E-01 WEIGHT=    1.570690D+00 (double torsional)
 310 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 311 ECORR4=   -6.006181E+01 WEIGHT=    4.288700D-01 (multi-body)
 312 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 313 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 314 EELLO=    -4.725545E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 315 ETURN3=    1.530709E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 316 ETURN4=   -7.157145E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
 317 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 318 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 319 EDIHC=     0.000000E+00 (dihedral angle constraints)
 320 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 321 UCONST=     0.000000E+00 (Constraint energy)
 322 EDFAD=     5.491269-315 (DFA distance energy)
 323 EDFAT=     6.953158-310 (DFA torsion energy)
 324 EDFAN=     6.953158-310 (DFA NCa energy)
 325 EDFAB=     2.650815-317 (DFA Beta energy)
 326 ETOT=     -8.672666E+01 (total)
 327 RMS deviation from the reference structure:   3.773
 328  % of native contacts:  33.333
 329  % of nonnative contacts:  81.818
 330  contact order:   0.390
 331  TM-score with the reference structure:     0.29
 332  Conformation #           9  read
 333
 334
 335  Conformation #           8  sumsl return code            4
 336
 337 Virtual-chain energies:
 338
 339 EVDW=     -5.862641E+01 WEIGHT=    1.352790D+00 (SC-SC)
 340 EVDW2=     5.301176E+01 WEIGHT=    1.593040D+00 (SC-p)
 341 EES=      -1.055439E+02 WEIGHT=    7.153400D-01 (p-p)
 342 EVDWPP=   -2.881512E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 343 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 344 EBE=      -3.731283E+01 WEIGHT=    1.138730D+00 (bending)
 345 ESC=       5.999344E+01 WEIGHT=    1.625800D-01 (SC local)
 346 ETORS=     1.274223E+01 WEIGHT=    1.985990D+00 (torsional)
 347 ETORSD=   -2.776734E+00 WEIGHT=    1.570690D+00 (double torsional)
 348 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 349 ECORR4=   -8.174841E+01 WEIGHT=    4.288700D-01 (multi-body)
 350 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 351 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 352 EELLO=    -6.338756E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 353 ETURN3=    1.909217E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 354 ETURN4=    4.173937E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
 355 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 356 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 357 EDIHC=     0.000000E+00 (dihedral angle constraints)
 358 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 359 UCONST=     0.000000E+00 (Constraint energy)
 360 EDFAD=     5.491269-315 (DFA distance energy)
 361 EDFAT=     6.953158-310 (DFA torsion energy)
 362 EDFAN=     6.953158-310 (DFA NCa energy)
 363 EDFAB=     2.650815-317 (DFA Beta energy)
 364 ETOT=     -8.926226E+01 (total)
 365 RMS deviation from the reference structure:   2.390
 366  % of native contacts:  50.000
 367  % of nonnative contacts:  76.000
 368  contact order:   0.336
 369  TM-score with the reference structure:     0.31
 370  Conformation #          10  read
 371
 372
 373  Conformation #           3  sumsl return code            4
 374
 375 Virtual-chain energies:
 376
 377 EVDW=     -5.446570E+01 WEIGHT=    1.352790D+00 (SC-SC)
 378 EVDW2=     5.095837E+01 WEIGHT=    1.593040D+00 (SC-p)
 379 EES=      -1.014688E+02 WEIGHT=    7.153400D-01 (p-p)
 380 EVDWPP=   -2.553049E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 381 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 382 EBE=      -3.717367E+01 WEIGHT=    1.138730D+00 (bending)
 383 ESC=       3.886158E+01 WEIGHT=    1.625800D-01 (SC local)
 384 ETORS=     9.379677E+00 WEIGHT=    1.985990D+00 (torsional)
 385 ETORSD=   -1.577902E-01 WEIGHT=    1.570690D+00 (double torsional)
 386 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 387 ECORR4=   -7.663803E+01 WEIGHT=    4.288700D-01 (multi-body)
 388 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 389 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 390 EELLO=    -5.522605E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 391 ETURN3=    1.798679E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 392 ETURN4=   -2.750991E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 393 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 394 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 395 EDIHC=     0.000000E+00 (dihedral angle constraints)
 396 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 397 UCONST=     0.000000E+00 (Constraint energy)
 398 EDFAD=     5.491269-315 (DFA distance energy)
 399 EDFAT=     6.953158-310 (DFA torsion energy)
 400 EDFAN=     6.953158-310 (DFA NCa energy)
 401 EDFAB=     2.650815-317 (DFA Beta energy)
 402 ETOT=     -9.084990E+01 (total)
 403 RMS deviation from the reference structure:   2.363
 404  % of native contacts:  50.000
 405  % of nonnative contacts:  73.913
 406  contact order:   0.328
 407  TM-score with the reference structure:     0.30
 408  Conformation #          11  read
 409
 410
 411  Conformation #           4  sumsl return code            4
 412
 413 Virtual-chain energies:
 414
 415 EVDW=     -5.606096E+01 WEIGHT=    1.352790D+00 (SC-SC)
 416 EVDW2=     5.183437E+01 WEIGHT=    1.593040D+00 (SC-p)
 417 EES=      -9.589161E+01 WEIGHT=    7.153400D-01 (p-p)
 418 EVDWPP=   -3.463962E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 419 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 420 EBE=      -3.689767E+01 WEIGHT=    1.138730D+00 (bending)
 421 ESC=       4.826127E+01 WEIGHT=    1.625800D-01 (SC local)
 422 ETORS=     1.089311E+01 WEIGHT=    1.985990D+00 (torsional)
 423 ETORSD=   -3.224204E+00 WEIGHT=    1.570690D+00 (double torsional)
 424 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 425 ECORR4=   -7.305783E+01 WEIGHT=    4.288700D-01 (multi-body)
 426 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 427 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 428 EELLO=    -5.019873E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 429 ETURN3=    1.660095E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 430 ETURN4=    1.544380E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 431 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 432 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 433 EDIHC=     0.000000E+00 (dihedral angle constraints)
 434 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 435 UCONST=     0.000000E+00 (Constraint energy)
 436 EDFAD=     5.491269-315 (DFA distance energy)
 437 EDFAT=     6.953158-310 (DFA torsion energy)
 438 EDFAN=     6.953158-310 (DFA NCa energy)
 439 EDFAB=     2.650815-317 (DFA Beta energy)
 440 ETOT=     -8.650422E+01 (total)
 441 RMS deviation from the reference structure:   2.838
 442  % of native contacts:  66.667
 443  % of nonnative contacts:  66.667
 444  contact order:   0.360
 445  TM-score with the reference structure:     0.30
 446  Conformation #          12  read
 447
 448
 449  Conformation #           5  sumsl return code            4
 450
 451 Virtual-chain energies:
 452
 453 EVDW=     -5.255290E+01 WEIGHT=    1.352790D+00 (SC-SC)
 454 EVDW2=     4.613237E+01 WEIGHT=    1.593040D+00 (SC-p)
 455 EES=      -8.862998E+01 WEIGHT=    7.153400D-01 (p-p)
 456 EVDWPP=   -1.686846E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 457 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 458 EBE=      -4.122921E+01 WEIGHT=    1.138730D+00 (bending)
 459 ESC=       3.531262E+01 WEIGHT=    1.625800D-01 (SC local)
 460 ETORS=     1.092826E+01 WEIGHT=    1.985990D+00 (torsional)
 461 ETORSD=   -2.038125E+00 WEIGHT=    1.570690D+00 (double torsional)
 462 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 463 ECORR4=   -6.579283E+01 WEIGHT=    4.288700D-01 (multi-body)
 464 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 465 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 466 EELLO=    -1.609632E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 467 ETURN3=    1.869754E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 468 ETURN4=   -5.053111E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 469 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 470 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 471 EDIHC=     0.000000E+00 (dihedral angle constraints)
 472 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 473 UCONST=     0.000000E+00 (Constraint energy)
 474 EDFAD=     5.491269-315 (DFA distance energy)
 475 EDFAT=     6.953158-310 (DFA torsion energy)
 476 EDFAN=     6.953158-310 (DFA NCa energy)
 477 EDFAB=     2.650815-317 (DFA Beta energy)
 478 ETOT=     -8.590119E+01 (total)
 479 RMS deviation from the reference structure:   5.007
 480  % of native contacts:  33.333
 481  % of nonnative contacts:  83.333
 482  contact order:   0.339
 483  TM-score with the reference structure:     0.26
 484  Conformation #          13  read
 485
 486
 487  Conformation #          12  sumsl return code            4
 488
 489 Virtual-chain energies:
 490
 491 EVDW=     -5.113255E+01 WEIGHT=    1.352790D+00 (SC-SC)
 492 EVDW2=     5.019779E+01 WEIGHT=    1.593040D+00 (SC-p)
 493 EES=      -9.003293E+01 WEIGHT=    7.153400D-01 (p-p)
 494 EVDWPP=   -3.975284E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 495 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 496 EBE=      -3.403177E+01 WEIGHT=    1.138730D+00 (bending)
 497 ESC=       2.528815E+01 WEIGHT=    1.625800D-01 (SC local)
 498 ETORS=     6.670682E+00 WEIGHT=    1.985990D+00 (torsional)
 499 ETORSD=    3.814703E-01 WEIGHT=    1.570690D+00 (double torsional)
 500 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 501 ECORR4=   -6.732171E+01 WEIGHT=    4.288700D-01 (multi-body)
 502 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 503 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 504 EELLO=    -5.201922E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 505 ETURN3=    1.498134E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 506 ETURN4=   -2.412060E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 507 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 508 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 509 EDIHC=     0.000000E+00 (dihedral angle constraints)
 510 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 511 UCONST=     0.000000E+00 (Constraint energy)
 512 EDFAD=     5.491269-315 (DFA distance energy)
 513 EDFAT=     6.953158-310 (DFA torsion energy)
 514 EDFAN=     6.953158-310 (DFA NCa energy)
 515 EDFAB=     2.650815-317 (DFA Beta energy)
 516 ETOT=     -8.495066E+01 (total)
 517 RMS deviation from the reference structure:   3.856
 518  % of native contacts:  33.333
 519  % of nonnative contacts:  78.947
 520  contact order:   0.409
 521  TM-score with the reference structure:     0.26
 522  Conformation #          14  read
 523
 524
 525  Conformation #           9  sumsl return code            4
 526
 527 Virtual-chain energies:
 528
 529 EVDW=     -5.332975E+01 WEIGHT=    1.352790D+00 (SC-SC)
 530 EVDW2=     4.661068E+01 WEIGHT=    1.593040D+00 (SC-p)
 531 EES=      -8.453295E+01 WEIGHT=    7.153400D-01 (p-p)
 532 EVDWPP=   -3.569863E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 533 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 534 EBE=      -3.585748E+01 WEIGHT=    1.138730D+00 (bending)
 535 ESC=       4.161979E+01 WEIGHT=    1.625800D-01 (SC local)
 536 ETORS=     9.791943E+00 WEIGHT=    1.985990D+00 (torsional)
 537 ETORSD=   -3.211485E+00 WEIGHT=    1.570690D+00 (double torsional)
 538 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 539 ECORR4=   -6.511112E+01 WEIGHT=    4.288700D-01 (multi-body)
 540 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 541 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 542 EELLO=    -2.001138E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 543 ETURN3=    1.467991E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 544 ETURN4=    2.448021E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 545 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 546 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 547 EDIHC=     0.000000E+00 (dihedral angle constraints)
 548 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 549 UCONST=     0.000000E+00 (Constraint energy)
 550 EDFAD=     5.491269-315 (DFA distance energy)
 551 EDFAT=     6.953158-310 (DFA torsion energy)
 552 EDFAN=     6.953158-310 (DFA NCa energy)
 553 EDFAB=     2.650815-317 (DFA Beta energy)
 554 ETOT=     -8.393890E+01 (total)
 555 RMS deviation from the reference structure:   3.263
 556  % of native contacts:  41.667
 557  % of nonnative contacts:  72.222
 558  contact order:   0.313
 559  TM-score with the reference structure:     0.28
 560  Conformation #          15  read
 561
 562
 563  Conformation #          11  sumsl return code            4
 564
 565 Virtual-chain energies:
 566
 567 EVDW=     -5.294992E+01 WEIGHT=    1.352790D+00 (SC-SC)
 568 EVDW2=     5.050672E+01 WEIGHT=    1.593040D+00 (SC-p)
 569 EES=      -1.003682E+02 WEIGHT=    7.153400D-01 (p-p)
 570 EVDWPP=   -2.331990E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 571 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 572 EBE=      -3.851707E+01 WEIGHT=    1.138730D+00 (bending)
 573 ESC=       4.201115E+01 WEIGHT=    1.625800D-01 (SC local)
 574 ETORS=     1.081144E+01 WEIGHT=    1.985990D+00 (torsional)
 575 ETORSD=   -8.681825E-01 WEIGHT=    1.570690D+00 (double torsional)
 576 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 577 ECORR4=   -7.698306E+01 WEIGHT=    4.288700D-01 (multi-body)
 578 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 579 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 580 EELLO=    -7.837837E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 581 ETURN3=    1.913565E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 582 ETURN4=    1.242277E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 583 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 584 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 585 EDIHC=     0.000000E+00 (dihedral angle constraints)
 586 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 587 UCONST=     0.000000E+00 (Constraint energy)
 588 EDFAD=     5.491269-315 (DFA distance energy)
 589 EDFAT=     6.953158-310 (DFA torsion energy)
 590 EDFAN=     6.953158-310 (DFA NCa energy)
 591 EDFAB=     2.650815-317 (DFA Beta energy)
 592 ETOT=     -8.370635E+01 (total)
 593 RMS deviation from the reference structure:   2.662
 594  % of native contacts:  50.000
 595  % of nonnative contacts:  68.421
 596  contact order:   0.268
 597  TM-score with the reference structure:     0.34
 598  Conformation #          16  read
 599
 600
 601  Conformation #          13  sumsl return code            4
 602
 603 Virtual-chain energies:
 604
 605 EVDW=     -5.568824E+01 WEIGHT=    1.352790D+00 (SC-SC)
 606 EVDW2=     4.807903E+01 WEIGHT=    1.593040D+00 (SC-p)
 607 EES=      -9.705815E+01 WEIGHT=    7.153400D-01 (p-p)
 608 EVDWPP=   -2.142859E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 609 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 610 EBE=      -3.949115E+01 WEIGHT=    1.138730D+00 (bending)
 611 ESC=       5.020830E+01 WEIGHT=    1.625800D-01 (SC local)
 612 ETORS=     1.211619E+01 WEIGHT=    1.985990D+00 (torsional)
 613 ETORSD=   -1.989802E+00 WEIGHT=    1.570690D+00 (double torsional)
 614 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 615 ECORR4=   -7.175321E+01 WEIGHT=    4.288700D-01 (multi-body)
 616 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 617 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 618 EELLO=    -3.799534E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 619 ETURN3=    1.920286E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 620 ETURN4=   -1.109910E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 621 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 622 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 623 EDIHC=     0.000000E+00 (dihedral angle constraints)
 624 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 625 UCONST=     0.000000E+00 (Constraint energy)
 626 EDFAD=     5.491269-315 (DFA distance energy)
 627 EDFAT=     6.953158-310 (DFA torsion energy)
 628 EDFAN=     6.953158-310 (DFA NCa energy)
 629 EDFAB=     2.650815-317 (DFA Beta energy)
 630 ETOT=     -8.619624E+01 (total)
 631 RMS deviation from the reference structure:   3.189
 632  % of native contacts:  33.333
 633  % of nonnative contacts:  77.778
 634  contact order:   0.333
 635  TM-score with the reference structure:     0.30
 636  Conformation #          17  read
 637
 638
 639  Conformation #          14  sumsl return code            4
 640
 641 Virtual-chain energies:
 642
 643 EVDW=     -5.435598E+01 WEIGHT=    1.352790D+00 (SC-SC)
 644 EVDW2=     5.746673E+01 WEIGHT=    1.593040D+00 (SC-p)
 645 EES=      -1.188868E+02 WEIGHT=    7.153400D-01 (p-p)
 646 EVDWPP=   -1.550369E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 647 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 648 EBE=      -4.309544E+01 WEIGHT=    1.138730D+00 (bending)
 649 ESC=       5.501581E+01 WEIGHT=    1.625800D-01 (SC local)
 650 ETORS=     1.332449E+01 WEIGHT=    1.985990D+00 (torsional)
 651 ETORSD=    1.706847E+00 WEIGHT=    1.570690D+00 (double torsional)
 652 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 653 ECORR4=   -8.438464E+01 WEIGHT=    4.288700D-01 (multi-body)
 654 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 655 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 656 EELLO=    -2.386849E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 657 ETURN3=    1.927296E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 658 ETURN4=   -2.127999E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 659 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 660 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 661 EDIHC=     0.000000E+00 (dihedral angle constraints)
 662 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 663 UCONST=     0.000000E+00 (Constraint energy)
 664 EDFAD=     5.491269-315 (DFA distance energy)
 665 EDFAT=     6.953158-310 (DFA torsion energy)
 666 EDFAN=     6.953158-310 (DFA NCa energy)
 667 EDFAB=     2.650815-317 (DFA Beta energy)
 668 ETOT=     -8.524364E+01 (total)
 669 RMS deviation from the reference structure:   2.759
 670  % of native contacts:  25.000
 671  % of nonnative contacts:  85.714
 672  contact order:   0.284
 673  TM-score with the reference structure:     0.28
 674  Conformation #          18  read
 675
 676
 677  Conformation #          10  sumsl return code            4
 678
 679 Virtual-chain energies:
 680
 681 EVDW=     -4.981905E+01 WEIGHT=    1.352790D+00 (SC-SC)
 682 EVDW2=     4.887691E+01 WEIGHT=    1.593040D+00 (SC-p)
 683 EES=      -9.530715E+01 WEIGHT=    7.153400D-01 (p-p)
 684 EVDWPP=   -2.323506E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 685 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 686 EBE=      -4.149720E+01 WEIGHT=    1.138730D+00 (bending)
 687 ESC=       4.631020E+01 WEIGHT=    1.625800D-01 (SC local)
 688 ETORS=     8.887848E+00 WEIGHT=    1.985990D+00 (torsional)
 689 ETORSD=    3.522291E-01 WEIGHT=    1.570690D+00 (double torsional)
 690 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 691 ECORR4=   -6.770895E+01 WEIGHT=    4.288700D-01 (multi-body)
 692 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 693 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 694 EELLO=    -2.963244E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 695 ETURN3=    1.745600E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 696 ETURN4=   -3.277685E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 697 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 698 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 699 EDIHC=     0.000000E+00 (dihedral angle constraints)
 700 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 701 UCONST=     0.000000E+00 (Constraint energy)
 702 EDFAD=     5.491269-315 (DFA distance energy)
 703 EDFAT=     6.953158-310 (DFA torsion energy)
 704 EDFAN=     6.953158-310 (DFA NCa energy)
 705 EDFAB=     2.650815-317 (DFA Beta energy)
 706 ETOT=     -8.410371E+01 (total)
 707 RMS deviation from the reference structure:   4.352
 708  % of native contacts:  33.333
 709  % of nonnative contacts:  80.000
 710  contact order:   0.314
 711  TM-score with the reference structure:     0.31
 712  Conformation #          19  read
 713
 714
 715  Conformation #           6  sumsl return code            4
 716
 717 Virtual-chain energies:
 718
 719 EVDW=     -4.823637E+01 WEIGHT=    1.352790D+00 (SC-SC)
 720 EVDW2=     5.043497E+01 WEIGHT=    1.593040D+00 (SC-p)
 721 EES=      -1.041185E+02 WEIGHT=    7.153400D-01 (p-p)
 722 EVDWPP=   -2.478391E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 723 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 724 EBE=      -4.213669E+01 WEIGHT=    1.138730D+00 (bending)
 725 ESC=       2.308211E+01 WEIGHT=    1.625800D-01 (SC local)
 726 ETORS=     1.276850E+01 WEIGHT=    1.985990D+00 (torsional)
 727 ETORSD=   -2.275841E+00 WEIGHT=    1.570690D+00 (double torsional)
 728 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 729 ECORR4=   -7.557997E+01 WEIGHT=    4.288700D-01 (multi-body)
 730 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 731 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 732 EELLO=    -9.440949E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 733 ETURN3=    1.819141E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 734 ETURN4=    5.679845E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 735 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 736 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 737 EDIHC=     0.000000E+00 (dihedral angle constraints)
 738 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 739 UCONST=     0.000000E+00 (Constraint energy)
 740 EDFAD=     5.491269-315 (DFA distance energy)
 741 EDFAT=     6.953158-310 (DFA torsion energy)
 742 EDFAN=     6.953158-310 (DFA NCa energy)
 743 EDFAB=     2.650815-317 (DFA Beta energy)
 744 ETOT=     -8.412650E+01 (total)
 745 RMS deviation from the reference structure:   4.360
 746  % of native contacts:  41.667
 747  % of nonnative contacts:  76.190
 748  contact order:   0.340
 749  TM-score with the reference structure:     0.26
 750  Conformation #          20  read
 751
 752
 753  Conformation #          18  sumsl return code            4
 754
 755 Virtual-chain energies:
 756
 757 EVDW=     -5.320903E+01 WEIGHT=    1.352790D+00 (SC-SC)
 758 EVDW2=     4.265324E+01 WEIGHT=    1.593040D+00 (SC-p)
 759 EES=      -7.984191E+01 WEIGHT=    7.153400D-01 (p-p)
 760 EVDWPP=   -2.514152E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 761 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 762 EBE=      -4.043931E+01 WEIGHT=    1.138730D+00 (bending)
 763 ESC=       4.975010E+01 WEIGHT=    1.625800D-01 (SC local)
 764 ETORS=     9.844163E+00 WEIGHT=    1.985990D+00 (torsional)
 765 ETORSD=   -3.039428E-01 WEIGHT=    1.570690D+00 (double torsional)
 766 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 767 ECORR4=   -5.337439E+01 WEIGHT=    4.288700D-01 (multi-body)
 768 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 769 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 770 EELLO=    -5.043572E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
 771 ETURN3=    1.310750E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 772 ETURN4=   -1.164680E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 773 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 774 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 775 EDIHC=     0.000000E+00 (dihedral angle constraints)
 776 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 777 UCONST=     0.000000E+00 (Constraint energy)
 778 EDFAD=     5.491269-315 (DFA distance energy)
 779 EDFAT=     6.953158-310 (DFA torsion energy)
 780 EDFAN=     6.953158-310 (DFA NCa energy)
 781 EDFAB=     2.650815-317 (DFA Beta energy)
 782 ETOT=     -8.452105E+01 (total)
 783 RMS deviation from the reference structure:   4.901
 784  % of native contacts:  16.667
 785  % of nonnative contacts:  88.889
 786  contact order:   0.354
 787  TM-score with the reference structure:     0.27
 788  Conformation #          21  read
 789
 790
 791  Conformation #          19  sumsl return code            4
 792
 793 Virtual-chain energies:
 794
 795 EVDW=     -5.355968E+01 WEIGHT=    1.352790D+00 (SC-SC)
 796 EVDW2=     5.202265E+01 WEIGHT=    1.593040D+00 (SC-p)
 797 EES=      -1.105238E+02 WEIGHT=    7.153400D-01 (p-p)
 798 EVDWPP=   -1.860241E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 799 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 800 EBE=      -3.883534E+01 WEIGHT=    1.138730D+00 (bending)
 801 ESC=       4.166351E+01 WEIGHT=    1.625800D-01 (SC local)
 802 ETORS=     1.340612E+01 WEIGHT=    1.985990D+00 (torsional)
 803 ETORSD=   -2.521998E+00 WEIGHT=    1.570690D+00 (double torsional)
 804 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 805 ECORR4=   -8.293655E+01 WEIGHT=    4.288700D-01 (multi-body)
 806 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 807 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 808 EELLO=    -3.693420E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 809 ETURN3=    2.130382E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 810 ETURN4=   -5.424474E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
 811 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 812 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 813 EDIHC=     0.000000E+00 (dihedral angle constraints)
 814 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 815 UCONST=     0.000000E+00 (Constraint energy)
 816 EDFAD=     5.491269-315 (DFA distance energy)
 817 EDFAT=     6.953158-310 (DFA torsion energy)
 818 EDFAN=     6.953158-310 (DFA NCa energy)
 819 EDFAB=     2.650815-317 (DFA Beta energy)
 820 ETOT=     -8.612065E+01 (total)
 821 RMS deviation from the reference structure:   2.066
 822  % of native contacts:  41.667
 823  % of nonnative contacts:  73.684
 824  contact order:   0.321
 825  TM-score with the reference structure:     0.30
 826  Conformation #          22  read
 827
 828
 829  Conformation #          15  sumsl return code            4
 830
 831 Virtual-chain energies:
 832
 833 EVDW=     -5.393971E+01 WEIGHT=    1.352790D+00 (SC-SC)
 834 EVDW2=     4.119798E+01 WEIGHT=    1.593040D+00 (SC-p)
 835 EES=      -6.697123E+01 WEIGHT=    7.153400D-01 (p-p)
 836 EVDWPP=   -3.107123E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 837 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 838 EBE=      -3.782482E+01 WEIGHT=    1.138730D+00 (bending)
 839 ESC=       4.791055E+01 WEIGHT=    1.625800D-01 (SC local)
 840 ETORS=     5.046919E+00 WEIGHT=    1.985990D+00 (torsional)
 841 ETORSD=   -1.223048E+00 WEIGHT=    1.570690D+00 (double torsional)
 842 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 843 ECORR4=   -4.759077E+01 WEIGHT=    4.288700D-01 (multi-body)
 844 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 845 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 846 EELLO=    -2.842830E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 847 ETURN3=    1.337713E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 848 ETURN4=   -1.286381E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 849 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 850 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 851 EDIHC=     0.000000E+00 (dihedral angle constraints)
 852 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 853 UCONST=     0.000000E+00 (Constraint energy)
 854 EDFAD=     5.491269-315 (DFA distance energy)
 855 EDFAT=     6.953158-310 (DFA torsion energy)
 856 EDFAN=     6.953158-310 (DFA NCa energy)
 857 EDFAB=     2.650815-317 (DFA Beta energy)
 858 ETOT=     -8.510817E+01 (total)
 859 RMS deviation from the reference structure:   5.534
 860  % of native contacts:  16.667
 861  % of nonnative contacts:  88.889
 862  contact order:   0.364
 863  TM-score with the reference structure:     0.22
 864  Conformation #          23  read
 865
 866
 867  Conformation #          16  sumsl return code            4
 868
 869 Virtual-chain energies:
 870
 871 EVDW=     -5.178581E+01 WEIGHT=    1.352790D+00 (SC-SC)
 872 EVDW2=     4.899764E+01 WEIGHT=    1.593040D+00 (SC-p)
 873 EES=      -1.022824E+02 WEIGHT=    7.153400D-01 (p-p)
 874 EVDWPP=   -2.355912E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 875 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 876 EBE=      -3.973775E+01 WEIGHT=    1.138730D+00 (bending)
 877 ESC=       4.925084E+01 WEIGHT=    1.625800D-01 (SC local)
 878 ETORS=     1.045547E+01 WEIGHT=    1.985990D+00 (torsional)
 879 ETORSD=    1.030940E+00 WEIGHT=    1.570690D+00 (double torsional)
 880 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 881 ECORR4=   -7.143612E+01 WEIGHT=    4.288700D-01 (multi-body)
 882 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 883 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 884 EELLO=    -3.207441E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 885 ETURN3=    1.751181E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 886 ETURN4=   -3.219025E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 887 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 888 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 889 EDIHC=     0.000000E+00 (dihedral angle constraints)
 890 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 891 UCONST=     0.000000E+00 (Constraint energy)
 892 EDFAD=     5.491269-315 (DFA distance energy)
 893 EDFAT=     6.953158-310 (DFA torsion energy)
 894 EDFAN=     6.953158-310 (DFA NCa energy)
 895 EDFAB=     2.650815-317 (DFA Beta energy)
 896 ETOT=     -8.644219E+01 (total)
 897 RMS deviation from the reference structure:   3.751
 898  % of native contacts:  41.667
 899  % of nonnative contacts:  72.222
 900  contact order:   0.280
 901  TM-score with the reference structure:     0.35
 902  Conformation #          24  read
 903
 904
 905  Conformation #          21  sumsl return code            4
 906
 907 Virtual-chain energies:
 908
 909 EVDW=     -5.209547E+01 WEIGHT=    1.352790D+00 (SC-SC)
 910 EVDW2=     4.960598E+01 WEIGHT=    1.593040D+00 (SC-p)
 911 EES=      -1.007532E+02 WEIGHT=    7.153400D-01 (p-p)
 912 EVDWPP=   -3.312577E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 913 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 914 EBE=      -3.692262E+01 WEIGHT=    1.138730D+00 (bending)
 915 ESC=       4.668591E+01 WEIGHT=    1.625800D-01 (SC local)
 916 ETORS=     9.319555E+00 WEIGHT=    1.985990D+00 (torsional)
 917 ETORSD=    7.202522E-01 WEIGHT=    1.570690D+00 (double torsional)
 918 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 919 ECORR4=   -7.522025E+01 WEIGHT=    4.288700D-01 (multi-body)
 920 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 921 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 922 EELLO=    -5.412357E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 923 ETURN3=    1.859969E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 924 ETURN4=   -3.150648E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
 925 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 926 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 927 EDIHC=     0.000000E+00 (dihedral angle constraints)
 928 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 929 UCONST=     0.000000E+00 (Constraint energy)
 930 EDFAD=     5.491269-315 (DFA distance energy)
 931 EDFAT=     6.953158-310 (DFA torsion energy)
 932 EDFAN=     6.953158-310 (DFA NCa energy)
 933 EDFAB=     2.650815-317 (DFA Beta energy)
 934 ETOT=     -8.593686E+01 (total)
 935 RMS deviation from the reference structure:   3.048
 936  % of native contacts:  41.667
 937  % of nonnative contacts:  72.222
 938  contact order:   0.308
 939  TM-score with the reference structure:     0.30
 940  Conformation #          25  read
 941
 942
 943  Conformation #          24  sumsl return code            4
 944
 945 Virtual-chain energies:
 946
 947 EVDW=     -5.959887E+01 WEIGHT=    1.352790D+00 (SC-SC)
 948 EVDW2=     5.259419E+01 WEIGHT=    1.593040D+00 (SC-p)
 949 EES=      -1.036390E+02 WEIGHT=    7.153400D-01 (p-p)
 950 EVDWPP=   -2.768958E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 951 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 952 EBE=      -3.730950E+01 WEIGHT=    1.138730D+00 (bending)
 953 ESC=       5.379161E+01 WEIGHT=    1.625800D-01 (SC local)
 954 ETORS=     1.228088E+01 WEIGHT=    1.985990D+00 (torsional)
 955 ETORSD=   -2.606335E+00 WEIGHT=    1.570690D+00 (double torsional)
 956 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 957 ECORR4=   -8.016506E+01 WEIGHT=    4.288700D-01 (multi-body)
 958 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 959 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 960 EELLO=    -5.103705E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
 961 ETURN3=    1.889639E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
 962 ETURN4=    1.885530E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
 963 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
 964 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
 965 EDIHC=     0.000000E+00 (dihedral angle constraints)
 966 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
 967 UCONST=     0.000000E+00 (Constraint energy)
 968 EDFAD=     5.491269-315 (DFA distance energy)
 969 EDFAT=     6.953158-310 (DFA torsion energy)
 970 EDFAN=     6.953158-310 (DFA NCa energy)
 971 EDFAB=     2.650815-317 (DFA Beta energy)
 972 ETOT=     -9.076142E+01 (total)
 973 RMS deviation from the reference structure:   2.745
 974  % of native contacts:  50.000
 975  % of nonnative contacts:  73.913
 976  contact order:   0.362
 977  TM-score with the reference structure:     0.32
 978  Conformation #          26  read
 979
 980
 981  Conformation #          17  sumsl return code            4
 982
 983 Virtual-chain energies:
 984
 985 EVDW=     -5.235103E+01 WEIGHT=    1.352790D+00 (SC-SC)
 986 EVDW2=     4.749328E+01 WEIGHT=    1.593040D+00 (SC-p)
 987 EES=      -9.670471E+01 WEIGHT=    7.153400D-01 (p-p)
 988 EVDWPP=   -2.194073E+01 WEIGHT=    1.137100D-01 (p-p VDW)
 989 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
 990 EBE=      -3.858333E+01 WEIGHT=    1.138730D+00 (bending)
 991 ESC=       2.961369E+01 WEIGHT=    1.625800D-01 (SC local)
 992 ETORS=     1.220687E+01 WEIGHT=    1.985990D+00 (torsional)
 993 ETORSD=   -2.575766E+00 WEIGHT=    1.570690D+00 (double torsional)
 994 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
 995 ECORR4=   -7.013102E+01 WEIGHT=    4.288700D-01 (multi-body)
 996 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 997 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
 998 EELLO=    -2.186376E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
 999 ETURN3=    1.709036E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1000 ETURN4=    1.631072E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1001 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1002 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1003 EDIHC=     0.000000E+00 (dihedral angle constraints)
1004 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1005 UCONST=     0.000000E+00 (Constraint energy)
1006 EDFAD=     5.491269-315 (DFA distance energy)
1007 EDFAT=     6.953158-310 (DFA torsion energy)
1008 EDFAN=     6.953158-310 (DFA NCa energy)
1009 EDFAB=     2.650815-317 (DFA Beta energy)
1010 ETOT=     -8.595398E+01 (total)
1011 RMS deviation from the reference structure:   3.547
1012  % of native contacts:  41.667
1013  % of nonnative contacts:  77.273
1014  contact order:   0.372
1015  TM-score with the reference structure:     0.29
1016  Conformation #          27  read
1017
1018
1019  Conformation #          20  sumsl return code            4
1020
1021 Virtual-chain energies:
1022
1023 EVDW=     -5.712491E+01 WEIGHT=    1.352790D+00 (SC-SC)
1024 EVDW2=     5.358028E+01 WEIGHT=    1.593040D+00 (SC-p)
1025 EES=      -1.023690E+02 WEIGHT=    7.153400D-01 (p-p)
1026 EVDWPP=   -3.246488E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1027 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1028 EBE=      -3.627658E+01 WEIGHT=    1.138730D+00 (bending)
1029 ESC=       4.396225E+01 WEIGHT=    1.625800D-01 (SC local)
1030 ETORS=     1.207184E+01 WEIGHT=    1.985990D+00 (torsional)
1031 ETORSD=   -3.068193E+00 WEIGHT=    1.570690D+00 (double torsional)
1032 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1033 ECORR4=   -8.012362E+01 WEIGHT=    4.288700D-01 (multi-body)
1034 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1035 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1036 EELLO=    -8.833236E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1037 ETURN3=    1.858513E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1038 ETURN4=    2.893610E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1039 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1040 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1041 EDIHC=     0.000000E+00 (dihedral angle constraints)
1042 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1043 UCONST=     0.000000E+00 (Constraint energy)
1044 EDFAD=     5.491269-315 (DFA distance energy)
1045 EDFAT=     6.953158-310 (DFA torsion energy)
1046 EDFAN=     6.953158-310 (DFA NCa energy)
1047 EDFAB=     2.650815-317 (DFA Beta energy)
1048 ETOT=     -8.635467E+01 (total)
1049 RMS deviation from the reference structure:   3.133
1050  % of native contacts:  41.667
1051  % of nonnative contacts:  76.190
1052  contact order:   0.377
1053  TM-score with the reference structure:     0.34
1054  Conformation #          28  read
1055
1056
1057  Conformation #          26  sumsl return code            4
1058
1059 Virtual-chain energies:
1060
1061 EVDW=     -4.966943E+01 WEIGHT=    1.352790D+00 (SC-SC)
1062 EVDW2=     4.446479E+01 WEIGHT=    1.593040D+00 (SC-p)
1063 EES=      -8.230876E+01 WEIGHT=    7.153400D-01 (p-p)
1064 EVDWPP=   -3.845007E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1065 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1066 EBE=      -3.848795E+01 WEIGHT=    1.138730D+00 (bending)
1067 ESC=       3.563903E+01 WEIGHT=    1.625800D-01 (SC local)
1068 ETORS=     7.357351E+00 WEIGHT=    1.985990D+00 (torsional)
1069 ETORSD=    2.882131E+00 WEIGHT=    1.570690D+00 (double torsional)
1070 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1071 ECORR4=   -5.997400E+01 WEIGHT=    4.288700D-01 (multi-body)
1072 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1073 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1074 EELLO=    -4.754856E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1075 ETURN3=    1.339753E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1076 ETURN4=   -6.125247E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1077 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1078 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1079 EDIHC=     0.000000E+00 (dihedral angle constraints)
1080 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1081 UCONST=     0.000000E+00 (Constraint energy)
1082 EDFAD=     5.491269-315 (DFA distance energy)
1083 EDFAT=     6.953158-310 (DFA torsion energy)
1084 EDFAN=     6.953158-310 (DFA NCa energy)
1085 EDFAB=     2.650815-317 (DFA Beta energy)
1086 ETOT=     -8.643936E+01 (total)
1087 RMS deviation from the reference structure:   3.024
1088  % of native contacts:  41.667
1089  % of nonnative contacts:  77.273
1090  contact order:   0.343
1091  TM-score with the reference structure:     0.26
1092  Conformation #          29  read
1093
1094
1095  Conformation #          22  sumsl return code            4
1096
1097 Virtual-chain energies:
1098
1099 EVDW=     -5.095490E+01 WEIGHT=    1.352790D+00 (SC-SC)
1100 EVDW2=     5.112544E+01 WEIGHT=    1.593040D+00 (SC-p)
1101 EES=      -1.033653E+02 WEIGHT=    7.153400D-01 (p-p)
1102 EVDWPP=   -2.049796E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1103 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1104 EBE=      -3.929489E+01 WEIGHT=    1.138730D+00 (bending)
1105 ESC=       3.705659E+01 WEIGHT=    1.625800D-01 (SC local)
1106 ETORS=     1.206529E+01 WEIGHT=    1.985990D+00 (torsional)
1107 ETORSD=   -2.136614E+00 WEIGHT=    1.570690D+00 (double torsional)
1108 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1109 ECORR4=   -7.597056E+01 WEIGHT=    4.288700D-01 (multi-body)
1110 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1111 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1112 EELLO=    -1.526397E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1113 ETURN3=    1.713811E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1114 ETURN4=   -1.676851E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1115 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1116 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1117 EDIHC=     0.000000E+00 (dihedral angle constraints)
1118 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1119 UCONST=     0.000000E+00 (Constraint energy)
1120 EDFAD=     5.491269-315 (DFA distance energy)
1121 EDFAT=     6.953158-310 (DFA torsion energy)
1122 EDFAN=     6.953158-310 (DFA NCa energy)
1123 EDFAB=     2.650815-317 (DFA Beta energy)
1124 ETOT=     -8.689564E+01 (total)
1125 RMS deviation from the reference structure:   4.042
1126  % of native contacts:  25.000
1127  % of nonnative contacts:  86.364
1128  contact order:   0.355
1129  TM-score with the reference structure:     0.31
1130  Conformation #          30  read
1131
1132
1133  Conformation #          25  sumsl return code            4
1134
1135 Virtual-chain energies:
1136
1137 EVDW=     -5.446035E+01 WEIGHT=    1.352790D+00 (SC-SC)
1138 EVDW2=     4.539208E+01 WEIGHT=    1.593040D+00 (SC-p)
1139 EES=      -7.761378E+01 WEIGHT=    7.153400D-01 (p-p)
1140 EVDWPP=   -4.074882E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1141 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1142 EBE=      -3.583179E+01 WEIGHT=    1.138730D+00 (bending)
1143 ESC=       4.395832E+01 WEIGHT=    1.625800D-01 (SC local)
1144 ETORS=     5.728579E+00 WEIGHT=    1.985990D+00 (torsional)
1145 ETORSD=    9.396842E-01 WEIGHT=    1.570690D+00 (double torsional)
1146 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1147 ECORR4=   -5.664059E+01 WEIGHT=    4.288700D-01 (multi-body)
1148 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1149 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1150 EELLO=    -4.264020E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1151 ETURN3=    1.267235E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1152 ETURN4=   -2.607153E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1153 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1154 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1155 EDIHC=     0.000000E+00 (dihedral angle constraints)
1156 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1157 UCONST=     0.000000E+00 (Constraint energy)
1158 EDFAD=     5.491269-315 (DFA distance energy)
1159 EDFAT=     6.953158-310 (DFA torsion energy)
1160 EDFAN=     6.953158-310 (DFA NCa energy)
1161 EDFAB=     2.650815-317 (DFA Beta energy)
1162 ETOT=     -8.763985E+01 (total)
1163 RMS deviation from the reference structure:   4.183
1164  % of native contacts:  58.333
1165  % of nonnative contacts:  68.182
1166  contact order:   0.424
1167  TM-score with the reference structure:     0.25
1168  Conformation #          31  read
1169
1170
1171  Conformation #          30  sumsl return code            4
1172
1173 Virtual-chain energies:
1174
1175 EVDW=     -5.148083E+01 WEIGHT=    1.352790D+00 (SC-SC)
1176 EVDW2=     4.919638E+01 WEIGHT=    1.593040D+00 (SC-p)
1177 EES=      -1.012524E+02 WEIGHT=    7.153400D-01 (p-p)
1178 EVDWPP=   -1.945164E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1179 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1180 EBE=      -4.129858E+01 WEIGHT=    1.138730D+00 (bending)
1181 ESC=       4.837667E+01 WEIGHT=    1.625800D-01 (SC local)
1182 ETORS=     9.795962E+00 WEIGHT=    1.985990D+00 (torsional)
1183 ETORSD=   -1.690453E+00 WEIGHT=    1.570690D+00 (double torsional)
1184 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1185 ECORR4=   -7.350380E+01 WEIGHT=    4.288700D-01 (multi-body)
1186 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1187 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1188 EELLO=    -1.266637E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1189 ETURN3=    2.042621E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1190 ETURN4=   -1.045593E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1191 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1192 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1193 EDIHC=     0.000000E+00 (dihedral angle constraints)
1194 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1195 UCONST=     0.000000E+00 (Constraint energy)
1196 EDFAD=     5.491269-315 (DFA distance energy)
1197 EDFAT=     6.953158-310 (DFA torsion energy)
1198 EDFAN=     6.953158-310 (DFA NCa energy)
1199 EDFAB=     2.650815-317 (DFA Beta energy)
1200 ETOT=     -8.623175E+01 (total)
1201 RMS deviation from the reference structure:   4.179
1202  % of native contacts:  41.667
1203  % of nonnative contacts:  76.190
1204  contact order:   0.301
1205  TM-score with the reference structure:     0.29
1206  Conformation #          32  read
1207
1208
1209  Conformation #          27  sumsl return code            4
1210
1211 Virtual-chain energies:
1212
1213 EVDW=     -5.566753E+01 WEIGHT=    1.352790D+00 (SC-SC)
1214 EVDW2=     5.517394E+01 WEIGHT=    1.593040D+00 (SC-p)
1215 EES=      -1.058416E+02 WEIGHT=    7.153400D-01 (p-p)
1216 EVDWPP=   -1.988803E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1217 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1218 EBE=      -3.773549E+01 WEIGHT=    1.138730D+00 (bending)
1219 ESC=       4.458700E+01 WEIGHT=    1.625800D-01 (SC local)
1220 ETORS=     1.060499E+01 WEIGHT=    1.985990D+00 (torsional)
1221 ETORSD=    2.037703E+00 WEIGHT=    1.570690D+00 (double torsional)
1222 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1223 ECORR4=   -7.367488E+01 WEIGHT=    4.288700D-01 (multi-body)
1224 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1225 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1226 EELLO=     1.339849E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1227 ETURN3=    1.580666E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1228 ETURN4=   -4.287983E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1229 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1230 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1231 EDIHC=     0.000000E+00 (dihedral angle constraints)
1232 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1233 UCONST=     0.000000E+00 (Constraint energy)
1234 EDFAD=     5.491269-315 (DFA distance energy)
1235 EDFAT=     6.953158-310 (DFA torsion energy)
1236 EDFAN=     6.953158-310 (DFA NCa energy)
1237 EDFAB=     2.650815-317 (DFA Beta energy)
1238 ETOT=     -8.439862E+01 (total)
1239 RMS deviation from the reference structure:   3.767
1240  % of native contacts:  25.000
1241  % of nonnative contacts:  86.364
1242  contact order:   0.353
1243  TM-score with the reference structure:     0.27
1244  Conformation #          33  read
1245
1246
1247  Conformation #          23  sumsl return code            4
1248
1249 Virtual-chain energies:
1250
1251 EVDW=     -5.151114E+01 WEIGHT=    1.352790D+00 (SC-SC)
1252 EVDW2=     5.421244E+01 WEIGHT=    1.593040D+00 (SC-p)
1253 EES=      -1.191587E+02 WEIGHT=    7.153400D-01 (p-p)
1254 EVDWPP=   -1.098248E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1255 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1256 EBE=      -4.122926E+01 WEIGHT=    1.138730D+00 (bending)
1257 ESC=       3.963812E+01 WEIGHT=    1.625800D-01 (SC local)
1258 ETORS=     1.456210E+01 WEIGHT=    1.985990D+00 (torsional)
1259 ETORSD=   -9.609385E-01 WEIGHT=    1.570690D+00 (double torsional)
1260 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1261 ECORR4=   -8.853870E+01 WEIGHT=    4.288700D-01 (multi-body)
1262 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1263 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1264 EELLO=    -4.469015E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1265 ETURN3=    2.007029E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1266 ETURN4=    6.260857E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
1267 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1268 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1269 EDIHC=     0.000000E+00 (dihedral angle constraints)
1270 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1271 UCONST=     0.000000E+00 (Constraint energy)
1272 EDFAD=     5.491269-315 (DFA distance energy)
1273 EDFAT=     6.953158-310 (DFA torsion energy)
1274 EDFAN=     6.953158-310 (DFA NCa energy)
1275 EDFAB=     2.650815-317 (DFA Beta energy)
1276 ETOT=     -8.666835E+01 (total)
1277 RMS deviation from the reference structure:   1.656
1278  % of native contacts:  66.667
1279  % of nonnative contacts:  61.905
1280  contact order:   0.288
1281  TM-score with the reference structure:     0.33
1282  Conformation #          34  read
1283
1284
1285  Conformation #          32  sumsl return code            4
1286
1287 Virtual-chain energies:
1288
1289 EVDW=     -5.386177E+01 WEIGHT=    1.352790D+00 (SC-SC)
1290 EVDW2=     4.358034E+01 WEIGHT=    1.593040D+00 (SC-p)
1291 EES=      -8.529005E+01 WEIGHT=    7.153400D-01 (p-p)
1292 EVDWPP=   -1.630550E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1293 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1294 EBE=      -3.952087E+01 WEIGHT=    1.138730D+00 (bending)
1295 ESC=       4.102800E+01 WEIGHT=    1.625800D-01 (SC local)
1296 ETORS=     1.013799E+01 WEIGHT=    1.985990D+00 (torsional)
1297 ETORSD=   -8.097761E-01 WEIGHT=    1.570690D+00 (double torsional)
1298 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1299 ECORR4=   -6.343370E+01 WEIGHT=    4.288700D-01 (multi-body)
1300 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1301 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1302 EELLO=    -3.398494E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1303 ETURN3=    1.752346E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1304 ETURN4=   -3.399737E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1305 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1306 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1307 EDIHC=     0.000000E+00 (dihedral angle constraints)
1308 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1309 UCONST=     0.000000E+00 (Constraint energy)
1310 EDFAD=     5.491269-315 (DFA distance energy)
1311 EDFAT=     6.953158-310 (DFA torsion energy)
1312 EDFAN=     6.953158-310 (DFA NCa energy)
1313 EDFAB=     2.650815-317 (DFA Beta energy)
1314 ETOT=     -8.621067E+01 (total)
1315 RMS deviation from the reference structure:   4.884
1316  % of native contacts:  33.333
1317  % of nonnative contacts:  80.000
1318  contact order:   0.307
1319  TM-score with the reference structure:     0.30
1320  Conformation #          35  read
1321
1322
1323  Conformation #          31  sumsl return code            4
1324
1325 Virtual-chain energies:
1326
1327 EVDW=     -4.757403E+01 WEIGHT=    1.352790D+00 (SC-SC)
1328 EVDW2=     3.776098E+01 WEIGHT=    1.593040D+00 (SC-p)
1329 EES=      -7.490258E+01 WEIGHT=    7.153400D-01 (p-p)
1330 EVDWPP=   -2.951580E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1331 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1332 EBE=      -4.045533E+01 WEIGHT=    1.138730D+00 (bending)
1333 ESC=       3.454962E+01 WEIGHT=    1.625800D-01 (SC local)
1334 ETORS=     8.451787E+00 WEIGHT=    1.985990D+00 (torsional)
1335 ETORSD=   -1.248463E+00 WEIGHT=    1.570690D+00 (double torsional)
1336 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1337 ECORR4=   -5.417918E+01 WEIGHT=    4.288700D-01 (multi-body)
1338 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1339 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1340 EELLO=     1.548068E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1341 ETURN3=    1.704547E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1342 ETURN4=   -4.132449E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1343 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1344 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1345 EDIHC=     0.000000E+00 (dihedral angle constraints)
1346 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1347 UCONST=     0.000000E+00 (Constraint energy)
1348 EDFAD=     5.491269-315 (DFA distance energy)
1349 EDFAT=     6.953158-310 (DFA torsion energy)
1350 EDFAN=     6.953158-310 (DFA NCa energy)
1351 EDFAB=     2.650815-317 (DFA Beta energy)
1352 ETOT=     -8.373142E+01 (total)
1353 RMS deviation from the reference structure:   3.878
1354  % of native contacts:  33.333
1355  % of nonnative contacts:  75.000
1356  contact order:   0.298
1357  TM-score with the reference structure:     0.32
1358  Conformation #          36  read
1359
1360
1361  Conformation #          33  sumsl return code            4
1362
1363 Virtual-chain energies:
1364
1365 EVDW=     -5.579419E+01 WEIGHT=    1.352790D+00 (SC-SC)
1366 EVDW2=     4.656001E+01 WEIGHT=    1.593040D+00 (SC-p)
1367 EES=      -9.320710E+01 WEIGHT=    7.153400D-01 (p-p)
1368 EVDWPP=   -3.039375E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1369 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1370 EBE=      -3.966957E+01 WEIGHT=    1.138730D+00 (bending)
1371 ESC=       5.203819E+01 WEIGHT=    1.625800D-01 (SC local)
1372 ETORS=     1.061114E+01 WEIGHT=    1.985990D+00 (torsional)
1373 ETORSD=    9.059798E-01 WEIGHT=    1.570690D+00 (double torsional)
1374 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1375 ECORR4=   -6.987199E+01 WEIGHT=    4.288700D-01 (multi-body)
1376 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1377 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1378 EELLO=     3.920321E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1379 ETURN3=    1.865457E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1380 ETURN4=   -3.243262E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1381 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1382 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1383 EDIHC=     0.000000E+00 (dihedral angle constraints)
1384 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1385 UCONST=     0.000000E+00 (Constraint energy)
1386 EDFAD=     5.491269-315 (DFA distance energy)
1387 EDFAT=     6.953158-310 (DFA torsion energy)
1388 EDFAN=     6.953158-310 (DFA NCa energy)
1389 EDFAB=     2.650815-317 (DFA Beta energy)
1390 ETOT=     -8.622940E+01 (total)
1391 RMS deviation from the reference structure:   2.901
1392  % of native contacts:  41.667
1393  % of nonnative contacts:  76.190
1394  contact order:   0.364
1395  TM-score with the reference structure:     0.28
1396  Conformation #          37  read
1397
1398
1399  Conformation #          35  sumsl return code            4
1400
1401 Virtual-chain energies:
1402
1403 EVDW=     -5.175155E+01 WEIGHT=    1.352790D+00 (SC-SC)
1404 EVDW2=     4.468048E+01 WEIGHT=    1.593040D+00 (SC-p)
1405 EES=      -8.926762E+01 WEIGHT=    7.153400D-01 (p-p)
1406 EVDWPP=   -1.161758E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1407 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1408 EBE=      -4.025622E+01 WEIGHT=    1.138730D+00 (bending)
1409 ESC=       3.330230E+01 WEIGHT=    1.625800D-01 (SC local)
1410 ETORS=     1.033048E+01 WEIGHT=    1.985990D+00 (torsional)
1411 ETORSD=   -1.314638E+00 WEIGHT=    1.570690D+00 (double torsional)
1412 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1413 ECORR4=   -6.617081E+01 WEIGHT=    4.288700D-01 (multi-body)
1414 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1415 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1416 EELLO=     8.525861E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1417 ETURN3=    1.768285E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1418 ETURN4=   -2.785642E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1419 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1420 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1421 EDIHC=     0.000000E+00 (dihedral angle constraints)
1422 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1423 UCONST=     0.000000E+00 (Constraint energy)
1424 EDFAD=     5.491269-315 (DFA distance energy)
1425 EDFAT=     6.953158-310 (DFA torsion energy)
1426 EDFAN=     6.953158-310 (DFA NCa energy)
1427 EDFAB=     2.650815-317 (DFA Beta energy)
1428 ETOT=     -8.623627E+01 (total)
1429 RMS deviation from the reference structure:   4.731
1430  % of native contacts:  25.000
1431  % of nonnative contacts:  83.333
1432  contact order:   0.402
1433  TM-score with the reference structure:     0.27
1434  Conformation #          38  read
1435
1436
1437  Conformation #          29  sumsl return code            4
1438
1439 Virtual-chain energies:
1440
1441 EVDW=     -5.462649E+01 WEIGHT=    1.352790D+00 (SC-SC)
1442 EVDW2=     4.339980E+01 WEIGHT=    1.593040D+00 (SC-p)
1443 EES=      -7.761039E+01 WEIGHT=    7.153400D-01 (p-p)
1444 EVDWPP=   -3.731447E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1445 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1446 EBE=      -3.514950E+01 WEIGHT=    1.138730D+00 (bending)
1447 ESC=       3.535474E+01 WEIGHT=    1.625800D-01 (SC local)
1448 ETORS=     9.107594E+00 WEIGHT=    1.985990D+00 (torsional)
1449 ETORSD=   -2.008088E+00 WEIGHT=    1.570690D+00 (double torsional)
1450 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1451 ECORR4=   -5.840195E+01 WEIGHT=    4.288700D-01 (multi-body)
1452 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1453 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1454 EELLO=    -3.447846E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1455 ETURN3=    1.412319E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1456 ETURN4=   -1.604587E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
1457 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1458 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1459 EDIHC=     0.000000E+00 (dihedral angle constraints)
1460 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1461 UCONST=     0.000000E+00 (Constraint energy)
1462 EDFAD=     5.491269-315 (DFA distance energy)
1463 EDFAT=     6.953158-310 (DFA torsion energy)
1464 EDFAN=     6.953158-310 (DFA NCa energy)
1465 EDFAB=     2.650815-317 (DFA Beta energy)
1466 ETOT=     -8.574281E+01 (total)
1467 RMS deviation from the reference structure:   3.699
1468  % of native contacts:  50.000
1469  % of nonnative contacts:  72.727
1470  contact order:   0.370
1471  TM-score with the reference structure:     0.21
1472  Conformation #          39  read
1473
1474
1475  Conformation #          38  sumsl return code            4
1476
1477 Virtual-chain energies:
1478
1479 EVDW=     -5.287387E+01 WEIGHT=    1.352790D+00 (SC-SC)
1480 EVDW2=     4.673019E+01 WEIGHT=    1.593040D+00 (SC-p)
1481 EES=      -8.718779E+01 WEIGHT=    7.153400D-01 (p-p)
1482 EVDWPP=   -1.712903E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1483 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1484 EBE=      -3.720143E+01 WEIGHT=    1.138730D+00 (bending)
1485 ESC=       4.168521E+01 WEIGHT=    1.625800D-01 (SC local)
1486 ETORS=     5.727931E+00 WEIGHT=    1.985990D+00 (torsional)
1487 ETORSD=    3.034983E-01 WEIGHT=    1.570690D+00 (double torsional)
1488 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1489 ECORR4=   -6.291846E+01 WEIGHT=    4.288700D-01 (multi-body)
1490 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1491 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1492 EELLO=    -4.820940E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1493 ETURN3=    1.688590E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1494 ETURN4=   -4.252842E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1495 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1496 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1497 EDIHC=     0.000000E+00 (dihedral angle constraints)
1498 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1499 UCONST=     0.000000E+00 (Constraint energy)
1500 EDFAD=     5.491269-315 (DFA distance energy)
1501 EDFAT=     6.953158-310 (DFA torsion energy)
1502 EDFAN=     6.953158-310 (DFA NCa energy)
1503 EDFAB=     2.650815-317 (DFA Beta energy)
1504 ETOT=     -8.721708E+01 (total)
1505 RMS deviation from the reference structure:   6.030
1506  % of native contacts:  33.333
1507  % of nonnative contacts:  81.818
1508  contact order:   0.364
1509  TM-score with the reference structure:     0.27
1510  Conformation #          40  read
1511
1512
1513  Conformation #          39  sumsl return code            4
1514
1515 Virtual-chain energies:
1516
1517 EVDW=     -5.120313E+01 WEIGHT=    1.352790D+00 (SC-SC)
1518 EVDW2=     5.194518E+01 WEIGHT=    1.593040D+00 (SC-p)
1519 EES=      -1.136502E+02 WEIGHT=    7.153400D-01 (p-p)
1520 EVDWPP=   -1.441422E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1521 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1522 EBE=      -4.117799E+01 WEIGHT=    1.138730D+00 (bending)
1523 ESC=       4.161658E+01 WEIGHT=    1.625800D-01 (SC local)
1524 ETORS=     1.466327E+01 WEIGHT=    1.985990D+00 (torsional)
1525 ETORSD=   -5.137958E-01 WEIGHT=    1.570690D+00 (double torsional)
1526 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1527 ECORR4=   -8.379204E+01 WEIGHT=    4.288700D-01 (multi-body)
1528 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1529 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1530 EELLO=    -3.118051E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1531 ETURN3=    2.040635E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1532 ETURN4=   -1.352274E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1533 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1534 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1535 EDIHC=     0.000000E+00 (dihedral angle constraints)
1536 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1537 UCONST=     0.000000E+00 (Constraint energy)
1538 EDFAD=     5.491269-315 (DFA distance energy)
1539 EDFAT=     6.953158-310 (DFA torsion energy)
1540 EDFAN=     6.953158-310 (DFA NCa energy)
1541 EDFAB=     2.650815-317 (DFA Beta energy)
1542 ETOT=     -8.371590E+01 (total)
1543 RMS deviation from the reference structure:   2.343
1544  % of native contacts:  50.000
1545  % of nonnative contacts:  68.421
1546  contact order:   0.292
1547  TM-score with the reference structure:     0.32
1548  Conformation #          41  read
1549
1550
1551  Conformation #          40  sumsl return code            4
1552
1553 Virtual-chain energies:
1554
1555 EVDW=     -5.514516E+01 WEIGHT=    1.352790D+00 (SC-SC)
1556 EVDW2=     5.303892E+01 WEIGHT=    1.593040D+00 (SC-p)
1557 EES=      -1.042350E+02 WEIGHT=    7.153400D-01 (p-p)
1558 EVDWPP=   -2.387461E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1559 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1560 EBE=      -3.684418E+01 WEIGHT=    1.138730D+00 (bending)
1561 ESC=       3.700316E+01 WEIGHT=    1.625800D-01 (SC local)
1562 ETORS=     9.499292E+00 WEIGHT=    1.985990D+00 (torsional)
1563 ETORSD=   -3.122060E-01 WEIGHT=    1.570690D+00 (double torsional)
1564 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1565 ECORR4=   -7.881446E+01 WEIGHT=    4.288700D-01 (multi-body)
1566 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1567 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1568 EELLO=    -5.862802E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1569 ETURN3=    1.834515E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1570 ETURN4=   -2.414443E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1571 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1572 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1573 EDIHC=     0.000000E+00 (dihedral angle constraints)
1574 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1575 UCONST=     0.000000E+00 (Constraint energy)
1576 EDFAD=     5.491269-315 (DFA distance energy)
1577 EDFAT=     6.953158-310 (DFA torsion energy)
1578 EDFAN=     6.953158-310 (DFA NCa energy)
1579 EDFAB=     2.650815-317 (DFA Beta energy)
1580 ETOT=     -9.033751E+01 (total)
1581 RMS deviation from the reference structure:   2.466
1582  % of native contacts:  50.000
1583  % of nonnative contacts:  73.913
1584  contact order:   0.356
1585  TM-score with the reference structure:     0.29
1586  Conformation #          42  read
1587
1588
1589  Conformation #          41  sumsl return code            4
1590
1591 Virtual-chain energies:
1592
1593 EVDW=     -5.493930E+01 WEIGHT=    1.352790D+00 (SC-SC)
1594 EVDW2=     5.334427E+01 WEIGHT=    1.593040D+00 (SC-p)
1595 EES=      -1.040855E+02 WEIGHT=    7.153400D-01 (p-p)
1596 EVDWPP=   -2.753694E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1597 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1598 EBE=      -3.938477E+01 WEIGHT=    1.138730D+00 (bending)
1599 ESC=       4.022215E+01 WEIGHT=    1.625800D-01 (SC local)
1600 ETORS=     1.009965E+01 WEIGHT=    1.985990D+00 (torsional)
1601 ETORSD=    1.641297E+00 WEIGHT=    1.570690D+00 (double torsional)
1602 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1603 ECORR4=   -7.797576E+01 WEIGHT=    4.288700D-01 (multi-body)
1604 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1605 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1606 EELLO=    -5.804926E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1607 ETURN3=    1.895956E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1608 ETURN4=   -3.615353E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1609 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1610 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1611 EDIHC=     0.000000E+00 (dihedral angle constraints)
1612 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1613 UCONST=     0.000000E+00 (Constraint energy)
1614 EDFAD=     5.491269-315 (DFA distance energy)
1615 EDFAT=     6.953158-310 (DFA torsion energy)
1616 EDFAN=     6.953158-310 (DFA NCa energy)
1617 EDFAB=     2.650815-317 (DFA Beta energy)
1618 ETOT=     -8.738089E+01 (total)
1619 RMS deviation from the reference structure:   1.785
1620  % of native contacts:  50.000
1621  % of nonnative contacts:  72.727
1622  contact order:   0.316
1623  TM-score with the reference structure:     0.31
1624  Conformation #          43  read
1625
1626
1627  Conformation #          36  sumsl return code            4
1628
1629 Virtual-chain energies:
1630
1631 EVDW=     -5.201704E+01 WEIGHT=    1.352790D+00 (SC-SC)
1632 EVDW2=     4.263827E+01 WEIGHT=    1.593040D+00 (SC-p)
1633 EES=      -8.824097E+01 WEIGHT=    7.153400D-01 (p-p)
1634 EVDWPP=   -1.501478E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1635 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1636 EBE=      -4.052596E+01 WEIGHT=    1.138730D+00 (bending)
1637 ESC=       3.928588E+01 WEIGHT=    1.625800D-01 (SC local)
1638 ETORS=     7.712220E+00 WEIGHT=    1.985990D+00 (torsional)
1639 ETORSD=   -2.113755E-01 WEIGHT=    1.570690D+00 (double torsional)
1640 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1641 ECORR4=   -6.152853E+01 WEIGHT=    4.288700D-01 (multi-body)
1642 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1643 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1644 EELLO=     1.512091E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1645 ETURN3=    1.890564E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1646 ETURN4=   -2.896462E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1647 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1648 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1649 EDIHC=     0.000000E+00 (dihedral angle constraints)
1650 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1651 UCONST=     0.000000E+00 (Constraint energy)
1652 EDFAD=     5.491269-315 (DFA distance energy)
1653 EDFAT=     6.953158-310 (DFA torsion energy)
1654 EDFAN=     6.953158-310 (DFA NCa energy)
1655 EDFAB=     2.650815-317 (DFA Beta energy)
1656 ETOT=     -8.821554E+01 (total)
1657 RMS deviation from the reference structure:   4.369
1658  % of native contacts:   8.333
1659  % of nonnative contacts:  93.333
1660  contact order:   0.333
1661  TM-score with the reference structure:     0.30
1662  Conformation #          44  read
1663
1664
1665  Conformation #          42  sumsl return code            4
1666
1667 Virtual-chain energies:
1668
1669 EVDW=     -5.435531E+01 WEIGHT=    1.352790D+00 (SC-SC)
1670 EVDW2=     5.158663E+01 WEIGHT=    1.593040D+00 (SC-p)
1671 EES=      -9.701329E+01 WEIGHT=    7.153400D-01 (p-p)
1672 EVDWPP=   -3.455228E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1673 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1674 EBE=      -3.759777E+01 WEIGHT=    1.138730D+00 (bending)
1675 ESC=       5.178419E+01 WEIGHT=    1.625800D-01 (SC local)
1676 ETORS=     1.130353E+01 WEIGHT=    1.985990D+00 (torsional)
1677 ETORSD=   -2.789281E+00 WEIGHT=    1.570690D+00 (double torsional)
1678 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1679 ECORR4=   -7.415274E+01 WEIGHT=    4.288700D-01 (multi-body)
1680 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1681 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1682 EELLO=    -5.109289E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1683 ETURN3=    1.630242E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1684 ETURN4=    7.205578E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
1685 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1686 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1687 EDIHC=     0.000000E+00 (dihedral angle constraints)
1688 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1689 UCONST=     0.000000E+00 (Constraint energy)
1690 EDFAD=     5.491269-315 (DFA distance energy)
1691 EDFAT=     6.953158-310 (DFA torsion energy)
1692 EDFAN=     6.953158-310 (DFA NCa energy)
1693 EDFAB=     2.650815-317 (DFA Beta energy)
1694 ETOT=     -8.564345E+01 (total)
1695 RMS deviation from the reference structure:   2.997
1696  % of native contacts:  58.333
1697  % of nonnative contacts:  69.565
1698  contact order:   0.338
1699  TM-score with the reference structure:     0.29
1700  Conformation #          45  read
1701
1702
1703  Conformation #          37  sumsl return code            4
1704
1705 Virtual-chain energies:
1706
1707 EVDW=     -5.106634E+01 WEIGHT=    1.352790D+00 (SC-SC)
1708 EVDW2=     3.947319E+01 WEIGHT=    1.593040D+00 (SC-p)
1709 EES=      -7.446918E+01 WEIGHT=    7.153400D-01 (p-p)
1710 EVDWPP=   -2.826681E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1711 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1712 EBE=      -4.011402E+01 WEIGHT=    1.138730D+00 (bending)
1713 ESC=       3.411674E+01 WEIGHT=    1.625800D-01 (SC local)
1714 ETORS=     8.269172E+00 WEIGHT=    1.985990D+00 (torsional)
1715 ETORSD=   -2.987229E+00 WEIGHT=    1.570690D+00 (double torsional)
1716 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1717 ECORR4=   -5.432415E+01 WEIGHT=    4.288700D-01 (multi-body)
1718 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1719 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1720 EELLO=    -4.298715E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1721 ETURN3=    1.598204E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1722 ETURN4=    1.192934E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1723 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1724 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1725 EDIHC=     0.000000E+00 (dihedral angle constraints)
1726 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1727 UCONST=     0.000000E+00 (Constraint energy)
1728 EDFAD=     5.491269-315 (DFA distance energy)
1729 EDFAT=     6.953158-310 (DFA torsion energy)
1730 EDFAN=     6.953158-310 (DFA NCa energy)
1731 EDFAB=     2.650815-317 (DFA Beta energy)
1732 ETOT=     -8.669815E+01 (total)
1733 RMS deviation from the reference structure:   4.583
1734  % of native contacts:  33.333
1735  % of nonnative contacts:  77.778
1736  contact order:   0.371
1737  TM-score with the reference structure:     0.34
1738  Conformation #          46  read
1739
1740
1741  Conformation #          28  sumsl return code            4
1742
1743 Virtual-chain energies:
1744
1745 EVDW=     -5.277345E+01 WEIGHT=    1.352790D+00 (SC-SC)
1746 EVDW2=     3.881418E+01 WEIGHT=    1.593040D+00 (SC-p)
1747 EES=      -7.118778E+01 WEIGHT=    7.153400D-01 (p-p)
1748 EVDWPP=   -2.463355E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1749 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1750 EBE=      -3.740744E+01 WEIGHT=    1.138730D+00 (bending)
1751 ESC=       4.577051E+01 WEIGHT=    1.625800D-01 (SC local)
1752 ETORS=     7.127622E+00 WEIGHT=    1.985990D+00 (torsional)
1753 ETORSD=   -2.755303E+00 WEIGHT=    1.570690D+00 (double torsional)
1754 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1755 ECORR4=   -5.370857E+01 WEIGHT=    4.288700D-01 (multi-body)
1756 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1757 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1758 EELLO=     5.273519E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
1759 ETURN3=    1.502927E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1760 ETURN4=    8.126764E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
1761 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1762 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1763 EDIHC=     0.000000E+00 (dihedral angle constraints)
1764 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1765 UCONST=     0.000000E+00 (Constraint energy)
1766 EDFAD=     5.491269-315 (DFA distance energy)
1767 EDFAT=     6.953158-310 (DFA torsion energy)
1768 EDFAN=     6.953158-310 (DFA NCa energy)
1769 EDFAB=     2.650815-317 (DFA Beta energy)
1770 ETOT=     -8.614926E+01 (total)
1771 RMS deviation from the reference structure:   4.957
1772  % of native contacts:  33.333
1773  % of nonnative contacts:  78.947
1774  contact order:   0.411
1775  TM-score with the reference structure:     0.29
1776  Conformation #          47  read
1777
1778
1779  Conformation #          45  sumsl return code            4
1780
1781 Virtual-chain energies:
1782
1783 EVDW=     -5.021897E+01 WEIGHT=    1.352790D+00 (SC-SC)
1784 EVDW2=     5.322494E+01 WEIGHT=    1.593040D+00 (SC-p)
1785 EES=      -1.169029E+02 WEIGHT=    7.153400D-01 (p-p)
1786 EVDWPP=   -1.020991E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1787 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1788 EBE=      -4.196052E+01 WEIGHT=    1.138730D+00 (bending)
1789 ESC=       3.899855E+01 WEIGHT=    1.625800D-01 (SC local)
1790 ETORS=     1.364603E+01 WEIGHT=    1.985990D+00 (torsional)
1791 ETORSD=   -4.346978E-01 WEIGHT=    1.570690D+00 (double torsional)
1792 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1793 ECORR4=   -8.405317E+01 WEIGHT=    4.288700D-01 (multi-body)
1794 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1795 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1796 EELLO=    -1.593220E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1797 ETURN3=    2.015378E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1798 ETURN4=   -6.595084E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
1799 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1800 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1801 EDIHC=     0.000000E+00 (dihedral angle constraints)
1802 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1803 UCONST=     0.000000E+00 (Constraint energy)
1804 EDFAD=     5.491269-315 (DFA distance energy)
1805 EDFAT=     6.953158-310 (DFA torsion energy)
1806 EDFAN=     6.953158-310 (DFA NCa energy)
1807 EDFAB=     2.650815-317 (DFA Beta energy)
1808 ETOT=     -8.569208E+01 (total)
1809 RMS deviation from the reference structure:   3.041
1810  % of native contacts:  41.667
1811  % of nonnative contacts:  72.222
1812  contact order:   0.293
1813  TM-score with the reference structure:     0.30
1814  Conformation #          48  read
1815
1816
1817  Conformation #          43  sumsl return code            4
1818
1819 Virtual-chain energies:
1820
1821 EVDW=     -5.140411E+01 WEIGHT=    1.352790D+00 (SC-SC)
1822 EVDW2=     4.674911E+01 WEIGHT=    1.593040D+00 (SC-p)
1823 EES=      -9.712785E+01 WEIGHT=    7.153400D-01 (p-p)
1824 EVDWPP=   -2.173440E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1825 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1826 EBE=      -3.858754E+01 WEIGHT=    1.138730D+00 (bending)
1827 ESC=       3.809296E+01 WEIGHT=    1.625800D-01 (SC local)
1828 ETORS=     1.223522E+01 WEIGHT=    1.985990D+00 (torsional)
1829 ETORSD=   -1.164073E+00 WEIGHT=    1.570690D+00 (double torsional)
1830 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1831 ECORR4=   -7.163596E+01 WEIGHT=    4.288700D-01 (multi-body)
1832 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1833 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1834 EELLO=    -1.643892E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1835 ETURN3=    1.696658E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1836 ETURN4=   -3.347090E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1837 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1838 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1839 EDIHC=     0.000000E+00 (dihedral angle constraints)
1840 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1841 UCONST=     0.000000E+00 (Constraint energy)
1842 EDFAD=     5.491269-315 (DFA distance energy)
1843 EDFAT=     6.953158-310 (DFA torsion energy)
1844 EDFAN=     6.953158-310 (DFA NCa energy)
1845 EDFAB=     2.650815-317 (DFA Beta energy)
1846 ETOT=     -8.687022E+01 (total)
1847 RMS deviation from the reference structure:   3.524
1848  % of native contacts:  16.667
1849  % of nonnative contacts:  88.889
1850  contact order:   0.323
1851  TM-score with the reference structure:     0.26
1852  Conformation #          49  read
1853
1854
1855  Conformation #          48  sumsl return code            4
1856
1857 Virtual-chain energies:
1858
1859 EVDW=     -5.307913E+01 WEIGHT=    1.352790D+00 (SC-SC)
1860 EVDW2=     4.607981E+01 WEIGHT=    1.593040D+00 (SC-p)
1861 EES=      -8.970217E+01 WEIGHT=    7.153400D-01 (p-p)
1862 EVDWPP=   -2.999373E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1863 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1864 EBE=      -3.575311E+01 WEIGHT=    1.138730D+00 (bending)
1865 ESC=       4.353289E+01 WEIGHT=    1.625800D-01 (SC local)
1866 ETORS=     7.550874E+00 WEIGHT=    1.985990D+00 (torsional)
1867 ETORSD=    3.550561E-01 WEIGHT=    1.570690D+00 (double torsional)
1868 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1869 ECORR4=   -6.830007E+01 WEIGHT=    4.288700D-01 (multi-body)
1870 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1871 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1872 EELLO=    -4.628660E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1873 ETURN3=    1.618282E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1874 ETURN4=   -1.376640E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1875 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1876 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1877 EDIHC=     0.000000E+00 (dihedral angle constraints)
1878 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1879 UCONST=     0.000000E+00 (Constraint energy)
1880 EDFAD=     5.491269-315 (DFA distance energy)
1881 EDFAT=     6.953158-310 (DFA torsion energy)
1882 EDFAN=     6.953158-310 (DFA NCa energy)
1883 EDFAB=     2.650815-317 (DFA Beta energy)
1884 ETOT=     -8.769988E+01 (total)
1885 RMS deviation from the reference structure:   3.343
1886  % of native contacts:  66.667
1887  % of nonnative contacts:  63.636
1888  contact order:   0.289
1889  TM-score with the reference structure:     0.31
1890  Conformation #          50  read
1891
1892
1893  Conformation #          49  sumsl return code            4
1894
1895 Virtual-chain energies:
1896
1897 EVDW=     -5.336219E+01 WEIGHT=    1.352790D+00 (SC-SC)
1898 EVDW2=     3.753434E+01 WEIGHT=    1.593040D+00 (SC-p)
1899 EES=      -6.708992E+01 WEIGHT=    7.153400D-01 (p-p)
1900 EVDWPP=   -2.305965E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1901 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1902 EBE=      -3.616040E+01 WEIGHT=    1.138730D+00 (bending)
1903 ESC=       4.552006E+01 WEIGHT=    1.625800D-01 (SC local)
1904 ETORS=     7.996487E+00 WEIGHT=    1.985990D+00 (torsional)
1905 ETORSD=   -1.079296E+00 WEIGHT=    1.570690D+00 (double torsional)
1906 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1907 ECORR4=   -4.616065E+01 WEIGHT=    4.288700D-01 (multi-body)
1908 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1909 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1910 EELLO=    -2.521817E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1911 ETURN3=    1.194346E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1912 ETURN4=   -1.693277E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1913 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1914 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1915 EDIHC=     0.000000E+00 (dihedral angle constraints)
1916 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1917 UCONST=     0.000000E+00 (Constraint energy)
1918 EDFAD=     5.491269-315 (DFA distance energy)
1919 EDFAT=     6.953158-310 (DFA torsion energy)
1920 EDFAN=     6.953158-310 (DFA NCa energy)
1921 EDFAB=     2.650815-317 (DFA Beta energy)
1922 ETOT=     -8.377046E+01 (total)
1923 RMS deviation from the reference structure:   4.936
1924  % of native contacts:  16.667
1925  % of nonnative contacts:  89.474
1926  contact order:   0.404
1927  TM-score with the reference structure:     0.25
1928  Conformation #          51  read
1929
1930
1931  Conformation #          50  sumsl return code            4
1932
1933 Virtual-chain energies:
1934
1935 EVDW=     -5.018245E+01 WEIGHT=    1.352790D+00 (SC-SC)
1936 EVDW2=     5.688365E+01 WEIGHT=    1.593040D+00 (SC-p)
1937 EES=      -1.133675E+02 WEIGHT=    7.153400D-01 (p-p)
1938 EVDWPP=   -2.448294E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1939 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1940 EBE=      -3.750686E+01 WEIGHT=    1.138730D+00 (bending)
1941 ESC=       3.082606E+01 WEIGHT=    1.625800D-01 (SC local)
1942 ETORS=     9.188676E+00 WEIGHT=    1.985990D+00 (torsional)
1943 ETORSD=   -2.040964E-01 WEIGHT=    1.570690D+00 (double torsional)
1944 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1945 ECORR4=   -7.981068E+01 WEIGHT=    4.288700D-01 (multi-body)
1946 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1947 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1948 EELLO=    -3.948025E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1949 ETURN3=    1.956677E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1950 ETURN4=   -3.539262E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
1951 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1952 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1953 EDIHC=     0.000000E+00 (dihedral angle constraints)
1954 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1955 UCONST=     0.000000E+00 (Constraint energy)
1956 EDFAD=     5.491269-315 (DFA distance energy)
1957 EDFAT=     6.953158-310 (DFA torsion energy)
1958 EDFAN=     6.953158-310 (DFA NCa energy)
1959 EDFAB=     2.650815-317 (DFA Beta energy)
1960 ETOT=     -8.511121E+01 (total)
1961 RMS deviation from the reference structure:   4.210
1962  % of native contacts:  41.667
1963  % of nonnative contacts:  77.273
1964  contact order:   0.345
1965  TM-score with the reference structure:     0.28
1966  Conformation #          52  read
1967
1968
1969  Conformation #          51  sumsl return code            4
1970
1971 Virtual-chain energies:
1972
1973 EVDW=     -5.201463E+01 WEIGHT=    1.352790D+00 (SC-SC)
1974 EVDW2=     4.743827E+01 WEIGHT=    1.593040D+00 (SC-p)
1975 EES=      -8.951823E+01 WEIGHT=    7.153400D-01 (p-p)
1976 EVDWPP=   -2.956350E+01 WEIGHT=    1.137100D-01 (p-p VDW)
1977 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
1978 EBE=      -4.210352E+01 WEIGHT=    1.138730D+00 (bending)
1979 ESC=       3.136984E+01 WEIGHT=    1.625800D-01 (SC local)
1980 ETORS=     9.460472E+00 WEIGHT=    1.985990D+00 (torsional)
1981 ETORSD=   -1.146980E+00 WEIGHT=    1.570690D+00 (double torsional)
1982 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
1983 ECORR4=   -6.428962E+01 WEIGHT=    4.288700D-01 (multi-body)
1984 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1985 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
1986 EELLO=    -2.826255E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
1987 ETURN3=    1.725980E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
1988 ETURN4=    1.159555E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
1989 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
1990 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
1991 EDIHC=     0.000000E+00 (dihedral angle constraints)
1992 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
1993 UCONST=     0.000000E+00 (Constraint energy)
1994 EDFAD=     5.491269-315 (DFA distance energy)
1995 EDFAT=     6.953158-310 (DFA torsion energy)
1996 EDFAN=     6.953158-310 (DFA NCa energy)
1997 EDFAB=     2.650815-317 (DFA Beta energy)
1998 ETOT=     -8.687626E+01 (total)
1999 RMS deviation from the reference structure:   4.608
2000  % of native contacts:  25.000
2001  % of nonnative contacts:  85.714
2002  contact order:   0.383
2003  TM-score with the reference structure:     0.30
2004  Conformation #          53  read
2005
2006
2007  Conformation #          46  sumsl return code            4
2008
2009 Virtual-chain energies:
2010
2011 EVDW=     -5.154839E+01 WEIGHT=    1.352790D+00 (SC-SC)
2012 EVDW2=     4.191969E+01 WEIGHT=    1.593040D+00 (SC-p)
2013 EES=      -8.798772E+01 WEIGHT=    7.153400D-01 (p-p)
2014 EVDWPP=   -1.459589E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2015 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2016 EBE=      -3.902199E+01 WEIGHT=    1.138730D+00 (bending)
2017 ESC=       3.865102E+01 WEIGHT=    1.625800D-01 (SC local)
2018 ETORS=     7.698028E+00 WEIGHT=    1.985990D+00 (torsional)
2019 ETORSD=   -1.822699E-01 WEIGHT=    1.570690D+00 (double torsional)
2020 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2021 ECORR4=   -6.142248E+01 WEIGHT=    4.288700D-01 (multi-body)
2022 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2023 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2024 EELLO=     1.636060E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2025 ETURN3=    1.890536E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2026 ETURN4=   -2.905968E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2027 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2028 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2029 EDIHC=     0.000000E+00 (dihedral angle constraints)
2030 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2031 UCONST=     0.000000E+00 (Constraint energy)
2032 EDFAD=     5.491269-315 (DFA distance energy)
2033 EDFAT=     6.953158-310 (DFA torsion energy)
2034 EDFAN=     6.953158-310 (DFA NCa energy)
2035 EDFAB=     2.650815-317 (DFA Beta energy)
2036 ETOT=     -8.681196E+01 (total)
2037 RMS deviation from the reference structure:   4.358
2038  % of native contacts:   8.333
2039  % of nonnative contacts:  93.333
2040  contact order:   0.333
2041  TM-score with the reference structure:     0.30
2042  Conformation #          54  read
2043
2044
2045  Conformation #          52  sumsl return code            4
2046
2047 Virtual-chain energies:
2048
2049 EVDW=     -5.374343E+01 WEIGHT=    1.352790D+00 (SC-SC)
2050 EVDW2=     3.076389E+01 WEIGHT=    1.593040D+00 (SC-p)
2051 EES=      -4.007468E+01 WEIGHT=    7.153400D-01 (p-p)
2052 EVDWPP=   -3.555488E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2053 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2054 EBE=      -3.854066E+01 WEIGHT=    1.138730D+00 (bending)
2055 ESC=       3.101077E+01 WEIGHT=    1.625800D-01 (SC local)
2056 ETORS=     4.361876E+00 WEIGHT=    1.985990D+00 (torsional)
2057 ETORSD=   -1.136974E+00 WEIGHT=    1.570690D+00 (double torsional)
2058 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2059 ECORR4=   -2.627170E+01 WEIGHT=    4.288700D-01 (multi-body)
2060 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2061 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2062 EELLO=     1.328577E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2063 ETURN3=    7.859060E+00 WEIGHT=    1.687220D+00 (turns, 3rd order)
2064 ETURN4=    1.249852E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2065 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2066 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2067 EDIHC=     0.000000E+00 (dihedral angle constraints)
2068 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2069 UCONST=     0.000000E+00 (Constraint energy)
2070 EDFAD=     5.491269-315 (DFA distance energy)
2071 EDFAT=     6.953158-310 (DFA torsion energy)
2072 EDFAN=     6.953158-310 (DFA NCa energy)
2073 EDFAB=     2.650815-317 (DFA Beta energy)
2074 ETOT=     -8.608564E+01 (total)
2075 RMS deviation from the reference structure:   5.439
2076  % of native contacts:  33.333
2077  % of nonnative contacts:  76.471
2078  contact order:   0.377
2079  TM-score with the reference structure:     0.20
2080  Conformation #          55  read
2081
2082
2083  Conformation #          54  sumsl return code            4
2084
2085 Virtual-chain energies:
2086
2087 EVDW=     -5.502204E+01 WEIGHT=    1.352790D+00 (SC-SC)
2088 EVDW2=     4.995068E+01 WEIGHT=    1.593040D+00 (SC-p)
2089 EES=      -8.998450E+01 WEIGHT=    7.153400D-01 (p-p)
2090 EVDWPP=   -3.419177E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2091 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2092 EBE=      -3.874727E+01 WEIGHT=    1.138730D+00 (bending)
2093 ESC=       4.916947E+01 WEIGHT=    1.625800D-01 (SC local)
2094 ETORS=     1.124203E+01 WEIGHT=    1.985990D+00 (torsional)
2095 ETORSD=   -3.679689E+00 WEIGHT=    1.570690D+00 (double torsional)
2096 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2097 ECORR4=   -6.658062E+01 WEIGHT=    4.288700D-01 (multi-body)
2098 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2099 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2100 EELLO=    -8.262522E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
2101 ETURN3=    1.592054E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2102 ETURN4=    3.803124E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2103 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2104 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2105 EDIHC=     0.000000E+00 (dihedral angle constraints)
2106 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2107 UCONST=     0.000000E+00 (Constraint energy)
2108 EDFAD=     5.491269-315 (DFA distance energy)
2109 EDFAT=     6.953158-310 (DFA torsion energy)
2110 EDFAN=     6.953158-310 (DFA NCa energy)
2111 EDFAB=     2.650815-317 (DFA Beta energy)
2112 ETOT=     -8.427270E+01 (total)
2113 RMS deviation from the reference structure:   3.064
2114  % of native contacts:  58.333
2115  % of nonnative contacts:  63.158
2116  contact order:   0.354
2117  TM-score with the reference structure:     0.25
2118  Conformation #          56  read
2119
2120
2121  Conformation #          47  sumsl return code            4
2122
2123 Virtual-chain energies:
2124
2125 EVDW=     -4.992304E+01 WEIGHT=    1.352790D+00 (SC-SC)
2126 EVDW2=     5.363912E+01 WEIGHT=    1.593040D+00 (SC-p)
2127 EES=      -1.166606E+02 WEIGHT=    7.153400D-01 (p-p)
2128 EVDWPP=   -1.666033E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2129 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2130 EBE=      -4.367353E+01 WEIGHT=    1.138730D+00 (bending)
2131 ESC=       3.147513E+01 WEIGHT=    1.625800D-01 (SC local)
2132 ETORS=     1.198322E+01 WEIGHT=    1.985990D+00 (torsional)
2133 ETORSD=    1.530666E+00 WEIGHT=    1.570690D+00 (double torsional)
2134 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2135 ECORR4=   -8.173211E+01 WEIGHT=    4.288700D-01 (multi-body)
2136 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2137 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2138 EELLO=    -4.102444E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2139 ETURN3=    2.027820E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2140 ETURN4=   -6.930762E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2141 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2142 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2143 EDIHC=     0.000000E+00 (dihedral angle constraints)
2144 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2145 UCONST=     0.000000E+00 (Constraint energy)
2146 EDFAD=     5.491269-315 (DFA distance energy)
2147 EDFAT=     6.953158-310 (DFA torsion energy)
2148 EDFAN=     6.953158-310 (DFA NCa energy)
2149 EDFAB=     2.650815-317 (DFA Beta energy)
2150 ETOT=     -8.780053E+01 (total)
2151 RMS deviation from the reference structure:   3.356
2152  % of native contacts:  25.000
2153  % of nonnative contacts:  84.211
2154  contact order:   0.306
2155  TM-score with the reference structure:     0.27
2156  Conformation #          57  read
2157
2158
2159  Conformation #           7  sumsl return code            4
2160
2161 Virtual-chain energies:
2162
2163 EVDW=     -4.928307E+01 WEIGHT=    1.352790D+00 (SC-SC)
2164 EVDW2=     4.086777E+01 WEIGHT=    1.593040D+00 (SC-p)
2165 EES=      -7.803956E+01 WEIGHT=    7.153400D-01 (p-p)
2166 EVDWPP=   -2.614427E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2167 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2168 EBE=      -3.767728E+01 WEIGHT=    1.138730D+00 (bending)
2169 ESC=       2.987521E+01 WEIGHT=    1.625800D-01 (SC local)
2170 ETORS=     7.313348E+00 WEIGHT=    1.985990D+00 (torsional)
2171 ETORSD=   -1.215591E+00 WEIGHT=    1.570690D+00 (double torsional)
2172 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2173 ECORR4=   -5.787940E+01 WEIGHT=    4.288700D-01 (multi-body)
2174 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2175 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2176 EELLO=     5.761960E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
2177 ETURN3=    1.546097E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2178 ETURN4=   -1.277757E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2179 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2180 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2181 EDIHC=     0.000000E+00 (dihedral angle constraints)
2182 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2183 UCONST=     0.000000E+00 (Constraint energy)
2184 EDFAD=     5.491269-315 (DFA distance energy)
2185 EDFAT=     6.953158-310 (DFA torsion energy)
2186 EDFAN=     6.953158-310 (DFA NCa energy)
2187 EDFAB=     2.650815-317 (DFA Beta energy)
2188 ETOT=     -8.528609E+01 (total)
2189 RMS deviation from the reference structure:   3.631
2190  % of native contacts:  33.333
2191  % of nonnative contacts:  76.471
2192  contact order:   0.313
2193  TM-score with the reference structure:     0.30
2194  Conformation #          58  read
2195
2196
2197  Conformation #          56  sumsl return code            4
2198
2199 Virtual-chain energies:
2200
2201 EVDW=     -5.229926E+01 WEIGHT=    1.352790D+00 (SC-SC)
2202 EVDW2=     4.445137E+01 WEIGHT=    1.593040D+00 (SC-p)
2203 EES=      -8.631679E+01 WEIGHT=    7.153400D-01 (p-p)
2204 EVDWPP=   -2.527296E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2205 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2206 EBE=      -3.865243E+01 WEIGHT=    1.138730D+00 (bending)
2207 ESC=       3.912605E+01 WEIGHT=    1.625800D-01 (SC local)
2208 ETORS=     7.862867E+00 WEIGHT=    1.985990D+00 (torsional)
2209 ETORSD=   -1.200357E+00 WEIGHT=    1.570690D+00 (double torsional)
2210 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2211 ECORR4=   -6.261065E+01 WEIGHT=    4.288700D-01 (multi-body)
2212 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2213 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2214 EELLO=    -1.482872E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2215 ETURN3=    1.806390E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2216 ETURN4=   -6.282756E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2217 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2218 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2219 EDIHC=     0.000000E+00 (dihedral angle constraints)
2220 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2221 UCONST=     0.000000E+00 (Constraint energy)
2222 EDFAD=     5.491269-315 (DFA distance energy)
2223 EDFAT=     6.953158-310 (DFA torsion energy)
2224 EDFAN=     6.953158-310 (DFA NCa energy)
2225 EDFAB=     2.650815-317 (DFA Beta energy)
2226 ETOT=     -8.550809E+01 (total)
2227 RMS deviation from the reference structure:   3.945
2228  % of native contacts:  41.667
2229  % of nonnative contacts:  76.190
2230  contact order:   0.338
2231  TM-score with the reference structure:     0.29
2232  Conformation #          59  read
2233
2234
2235  Conformation #          53  sumsl return code            4
2236
2237 Virtual-chain energies:
2238
2239 EVDW=     -5.364036E+01 WEIGHT=    1.352790D+00 (SC-SC)
2240 EVDW2=     4.404233E+01 WEIGHT=    1.593040D+00 (SC-p)
2241 EES=      -8.760155E+01 WEIGHT=    7.153400D-01 (p-p)
2242 EVDWPP=   -1.758501E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2243 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2244 EBE=      -3.738427E+01 WEIGHT=    1.138730D+00 (bending)
2245 ESC=       4.781087E+01 WEIGHT=    1.625800D-01 (SC local)
2246 ETORS=     8.626289E+00 WEIGHT=    1.985990D+00 (torsional)
2247 ETORSD=   -1.512410E+00 WEIGHT=    1.570690D+00 (double torsional)
2248 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2249 ECORR4=   -6.329352E+01 WEIGHT=    4.288700D-01 (multi-body)
2250 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2251 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2252 EELLO=     3.769700E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2253 ETURN3=    1.809807E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2254 ETURN4=   -2.885832E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2255 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2256 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2257 EDIHC=     0.000000E+00 (dihedral angle constraints)
2258 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2259 UCONST=     0.000000E+00 (Constraint energy)
2260 EDFAD=     5.491269-315 (DFA distance energy)
2261 EDFAT=     6.953158-310 (DFA torsion energy)
2262 EDFAN=     6.953158-310 (DFA NCa energy)
2263 EDFAB=     2.650815-317 (DFA Beta energy)
2264 ETOT=     -8.502478E+01 (total)
2265 RMS deviation from the reference structure:   4.868
2266  % of native contacts:  16.667
2267  % of nonnative contacts:  86.667
2268  contact order:   0.324
2269  TM-score with the reference structure:     0.29
2270  Conformation #          60  read
2271
2272
2273  Conformation #          44  sumsl return code            4
2274
2275 Virtual-chain energies:
2276
2277 EVDW=     -5.188388E+01 WEIGHT=    1.352790D+00 (SC-SC)
2278 EVDW2=     5.029902E+01 WEIGHT=    1.593040D+00 (SC-p)
2279 EES=      -1.027856E+02 WEIGHT=    7.153400D-01 (p-p)
2280 EVDWPP=   -2.449355E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2281 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2282 EBE=      -3.812501E+01 WEIGHT=    1.138730D+00 (bending)
2283 ESC=       4.204499E+01 WEIGHT=    1.625800D-01 (SC local)
2284 ETORS=     9.719410E+00 WEIGHT=    1.985990D+00 (torsional)
2285 ETORSD=    7.237824E-01 WEIGHT=    1.570690D+00 (double torsional)
2286 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2287 ECORR4=   -7.720037E+01 WEIGHT=    4.288700D-01 (multi-body)
2288 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2289 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2290 EELLO=    -3.693599E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2291 ETURN3=    1.815449E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2292 ETURN4=   -2.968524E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2293 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2294 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2295 EDIHC=     0.000000E+00 (dihedral angle constraints)
2296 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2297 UCONST=     0.000000E+00 (Constraint energy)
2298 EDFAD=     5.491269-315 (DFA distance energy)
2299 EDFAT=     6.953158-310 (DFA torsion energy)
2300 EDFAN=     6.953158-310 (DFA NCa energy)
2301 EDFAB=     2.650815-317 (DFA Beta energy)
2302 ETOT=     -8.754707E+01 (total)
2303 RMS deviation from the reference structure:   3.198
2304  % of native contacts:  50.000
2305  % of nonnative contacts:  70.000
2306  contact order:   0.327
2307  TM-score with the reference structure:     0.29
2308  Conformation #          61  read
2309
2310
2311  Conformation #          55  sumsl return code            4
2312
2313 Virtual-chain energies:
2314
2315 EVDW=     -5.453480E+01 WEIGHT=    1.352790D+00 (SC-SC)
2316 EVDW2=     4.842847E+01 WEIGHT=    1.593040D+00 (SC-p)
2317 EES=      -8.558465E+01 WEIGHT=    7.153400D-01 (p-p)
2318 EVDWPP=   -3.665044E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2319 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2320 EBE=      -3.689607E+01 WEIGHT=    1.138730D+00 (bending)
2321 ESC=       4.344523E+01 WEIGHT=    1.625800D-01 (SC local)
2322 ETORS=     9.459575E+00 WEIGHT=    1.985990D+00 (torsional)
2323 ETORSD=   -3.275427E+00 WEIGHT=    1.570690D+00 (double torsional)
2324 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2325 ECORR4=   -6.585480E+01 WEIGHT=    4.288700D-01 (multi-body)
2326 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2327 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2328 EELLO=    -2.107669E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2329 ETURN3=    1.468449E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2330 ETURN4=    2.553064E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2331 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2332 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2333 EDIHC=     0.000000E+00 (dihedral angle constraints)
2334 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2335 UCONST=     0.000000E+00 (Constraint energy)
2336 EDFAD=     5.491269-315 (DFA distance energy)
2337 EDFAT=     6.953158-310 (DFA torsion energy)
2338 EDFAN=     6.953158-310 (DFA NCa energy)
2339 EDFAB=     2.650815-317 (DFA Beta energy)
2340 ETOT=     -8.543896E+01 (total)
2341 RMS deviation from the reference structure:   3.301
2342  % of native contacts:  50.000
2343  % of nonnative contacts:  70.000
2344  contact order:   0.330
2345  TM-score with the reference structure:     0.28
2346  Conformation #          62  read
2347
2348
2349  Conformation #          61  sumsl return code            4
2350
2351 Virtual-chain energies:
2352
2353 EVDW=     -5.317755E+01 WEIGHT=    1.352790D+00 (SC-SC)
2354 EVDW2=     4.529984E+01 WEIGHT=    1.593040D+00 (SC-p)
2355 EES=      -9.070004E+01 WEIGHT=    7.153400D-01 (p-p)
2356 EVDWPP=   -1.923018E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2357 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2358 EBE=      -4.062870E+01 WEIGHT=    1.138730D+00 (bending)
2359 ESC=       4.442335E+01 WEIGHT=    1.625800D-01 (SC local)
2360 ETORS=     9.530746E+00 WEIGHT=    1.985990D+00 (torsional)
2361 ETORSD=   -8.878436E-01 WEIGHT=    1.570690D+00 (double torsional)
2362 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2363 ECORR4=   -6.241854E+01 WEIGHT=    4.288700D-01 (multi-body)
2364 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2365 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2366 EELLO=     2.760952E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2367 ETURN3=    1.832901E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2368 ETURN4=   -3.414633E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2369 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2370 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2371 EDIHC=     0.000000E+00 (dihedral angle constraints)
2372 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2373 UCONST=     0.000000E+00 (Constraint energy)
2374 EDFAD=     5.491269-315 (DFA distance energy)
2375 EDFAT=     6.953158-310 (DFA torsion energy)
2376 EDFAN=     6.953158-310 (DFA NCa energy)
2377 EDFAB=     2.650815-317 (DFA Beta energy)
2378 ETOT=     -8.601411E+01 (total)
2379 RMS deviation from the reference structure:   4.202
2380  % of native contacts:   8.333
2381  % of nonnative contacts:  94.737
2382  contact order:   0.333
2383  TM-score with the reference structure:     0.29
2384  Conformation #          63  read
2385
2386
2387  Conformation #          59  sumsl return code            4
2388
2389 Virtual-chain energies:
2390
2391 EVDW=     -5.179106E+01 WEIGHT=    1.352790D+00 (SC-SC)
2392 EVDW2=     4.629455E+01 WEIGHT=    1.593040D+00 (SC-p)
2393 EES=      -8.841907E+01 WEIGHT=    7.153400D-01 (p-p)
2394 EVDWPP=   -3.028376E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2395 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2396 EBE=      -3.740849E+01 WEIGHT=    1.138730D+00 (bending)
2397 ESC=       4.534205E+01 WEIGHT=    1.625800D-01 (SC local)
2398 ETORS=     7.102459E+00 WEIGHT=    1.985990D+00 (torsional)
2399 ETORSD=    4.089874E-01 WEIGHT=    1.570690D+00 (double torsional)
2400 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2401 ECORR4=   -6.720389E+01 WEIGHT=    4.288700D-01 (multi-body)
2402 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2403 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2404 EELLO=    -3.760680E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2405 ETURN3=    1.538745E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2406 ETURN4=   -1.996456E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2407 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2408 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2409 EDIHC=     0.000000E+00 (dihedral angle constraints)
2410 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2411 UCONST=     0.000000E+00 (Constraint energy)
2412 EDFAD=     5.491269-315 (DFA distance energy)
2413 EDFAT=     6.953158-310 (DFA torsion energy)
2414 EDFAN=     6.953158-310 (DFA NCa energy)
2415 EDFAB=     2.650815-317 (DFA Beta energy)
2416 ETOT=     -8.827031E+01 (total)
2417 RMS deviation from the reference structure:   3.170
2418  % of native contacts:  66.667
2419  % of nonnative contacts:  61.905
2420  contact order:   0.271
2421  TM-score with the reference structure:     0.30
2422  Conformation #          64  read
2423
2424
2425  Conformation #          57  sumsl return code            4
2426
2427 Virtual-chain energies:
2428
2429 EVDW=     -5.042310E+01 WEIGHT=    1.352790D+00 (SC-SC)
2430 EVDW2=     4.600243E+01 WEIGHT=    1.593040D+00 (SC-p)
2431 EES=      -9.490518E+01 WEIGHT=    7.153400D-01 (p-p)
2432 EVDWPP=   -2.285929E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2433 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2434 EBE=      -3.988336E+01 WEIGHT=    1.138730D+00 (bending)
2435 ESC=       2.607804E+01 WEIGHT=    1.625800D-01 (SC local)
2436 ETORS=     1.210209E+01 WEIGHT=    1.985990D+00 (torsional)
2437 ETORSD=   -1.324364E+00 WEIGHT=    1.570690D+00 (double torsional)
2438 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2439 ECORR4=   -6.755724E+01 WEIGHT=    4.288700D-01 (multi-body)
2440 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2441 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2442 EELLO=    -1.722919E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2443 ETURN3=    1.653230E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2444 ETURN4=    1.184771E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2445 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2446 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2447 EDIHC=     0.000000E+00 (dihedral angle constraints)
2448 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2449 UCONST=     0.000000E+00 (Constraint energy)
2450 EDFAD=     5.491269-315 (DFA distance energy)
2451 EDFAT=     6.953158-310 (DFA torsion energy)
2452 EDFAN=     6.953158-310 (DFA NCa energy)
2453 EDFAB=     2.650815-317 (DFA Beta energy)
2454 ETOT=     -8.521035E+01 (total)
2455 RMS deviation from the reference structure:   3.790
2456  % of native contacts:  33.333
2457  % of nonnative contacts:  80.000
2458  contact order:   0.366
2459  TM-score with the reference structure:     0.26
2460  Conformation #          65  read
2461
2462
2463  Conformation #          64  sumsl return code            4
2464
2465 Virtual-chain energies:
2466
2467 EVDW=     -5.295550E+01 WEIGHT=    1.352790D+00 (SC-SC)
2468 EVDW2=     4.795870E+01 WEIGHT=    1.593040D+00 (SC-p)
2469 EES=      -9.040875E+01 WEIGHT=    7.153400D-01 (p-p)
2470 EVDWPP=   -3.132648E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2471 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2472 EBE=      -3.699492E+01 WEIGHT=    1.138730D+00 (bending)
2473 ESC=       5.102125E+01 WEIGHT=    1.625800D-01 (SC local)
2474 ETORS=     7.902693E+00 WEIGHT=    1.985990D+00 (torsional)
2475 ETORSD=    7.791768E-02 WEIGHT=    1.570690D+00 (double torsional)
2476 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2477 ECORR4=   -6.708701E+01 WEIGHT=    4.288700D-01 (multi-body)
2478 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2479 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2480 EELLO=    -6.280698E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2481 ETURN3=    1.656308E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2482 ETURN4=   -2.938435E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2483 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2484 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2485 EDIHC=     0.000000E+00 (dihedral angle constraints)
2486 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2487 UCONST=     0.000000E+00 (Constraint energy)
2488 EDFAD=     5.491269-315 (DFA distance energy)
2489 EDFAT=     6.953158-310 (DFA torsion energy)
2490 EDFAN=     6.953158-310 (DFA NCa energy)
2491 EDFAB=     2.650815-317 (DFA Beta energy)
2492 ETOT=     -8.526715E+01 (total)
2493 RMS deviation from the reference structure:   3.284
2494  % of native contacts:  50.000
2495  % of nonnative contacts:  72.727
2496  contact order:   0.351
2497  TM-score with the reference structure:     0.30
2498  Conformation #          66  read
2499
2500
2501  Conformation #          60  sumsl return code            4
2502
2503 Virtual-chain energies:
2504
2505 EVDW=     -5.630734E+01 WEIGHT=    1.352790D+00 (SC-SC)
2506 EVDW2=     4.879338E+01 WEIGHT=    1.593040D+00 (SC-p)
2507 EES=      -9.755453E+01 WEIGHT=    7.153400D-01 (p-p)
2508 EVDWPP=   -2.152566E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2509 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2510 EBE=      -4.046953E+01 WEIGHT=    1.138730D+00 (bending)
2511 ESC=       4.955701E+01 WEIGHT=    1.625800D-01 (SC local)
2512 ETORS=     1.221616E+01 WEIGHT=    1.985990D+00 (torsional)
2513 ETORSD=   -2.112377E+00 WEIGHT=    1.570690D+00 (double torsional)
2514 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2515 ECORR4=   -7.225855E+01 WEIGHT=    4.288700D-01 (multi-body)
2516 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2517 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2518 EELLO=    -3.713139E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2519 ETURN3=    1.932526E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2520 ETURN4=   -7.551985E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2521 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2522 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2523 EDIHC=     0.000000E+00 (dihedral angle constraints)
2524 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2525 UCONST=     0.000000E+00 (Constraint energy)
2526 EDFAD=     5.491269-315 (DFA distance energy)
2527 EDFAT=     6.953158-310 (DFA torsion energy)
2528 EDFAN=     6.953158-310 (DFA NCa energy)
2529 EDFAB=     2.650815-317 (DFA Beta energy)
2530 ETOT=     -8.723730E+01 (total)
2531 RMS deviation from the reference structure:   3.297
2532  % of native contacts:  25.000
2533  % of nonnative contacts:  82.353
2534  contact order:   0.353
2535  TM-score with the reference structure:     0.30
2536  Conformation #          67  read
2537
2538
2539  Conformation #          65  sumsl return code            4
2540
2541 Virtual-chain energies:
2542
2543 EVDW=     -5.186846E+01 WEIGHT=    1.352790D+00 (SC-SC)
2544 EVDW2=     3.687270E+01 WEIGHT=    1.593040D+00 (SC-p)
2545 EES=      -6.703374E+01 WEIGHT=    7.153400D-01 (p-p)
2546 EVDWPP=   -2.641379E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2547 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2548 EBE=      -4.036413E+01 WEIGHT=    1.138730D+00 (bending)
2549 ESC=       3.676547E+01 WEIGHT=    1.625800D-01 (SC local)
2550 ETORS=     9.012940E+00 WEIGHT=    1.985990D+00 (torsional)
2551 ETORSD=   -2.382653E+00 WEIGHT=    1.570690D+00 (double torsional)
2552 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2553 ECORR4=   -4.979189E+01 WEIGHT=    4.288700D-01 (multi-body)
2554 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2555 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2556 EELLO=     5.277529E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
2557 ETURN3=    1.436494E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2558 ETURN4=    4.574259E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2559 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2560 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2561 EDIHC=     0.000000E+00 (dihedral angle constraints)
2562 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2563 UCONST=     0.000000E+00 (Constraint energy)
2564 EDFAD=     5.491269-315 (DFA distance energy)
2565 EDFAT=     6.953158-310 (DFA torsion energy)
2566 EDFAN=     6.953158-310 (DFA NCa energy)
2567 EDFAB=     2.650815-317 (DFA Beta energy)
2568 ETOT=     -8.494206E+01 (total)
2569 RMS deviation from the reference structure:   5.112
2570  % of native contacts:  33.333
2571  % of nonnative contacts:  78.947
2572  contact order:   0.361
2573  TM-score with the reference structure:     0.28
2574  Conformation #          68  read
2575
2576
2577  Conformation #          58  sumsl return code            4
2578
2579 Virtual-chain energies:
2580
2581 EVDW=     -5.186232E+01 WEIGHT=    1.352790D+00 (SC-SC)
2582 EVDW2=     3.807428E+01 WEIGHT=    1.593040D+00 (SC-p)
2583 EES=      -7.112529E+01 WEIGHT=    7.153400D-01 (p-p)
2584 EVDWPP=   -2.420347E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2585 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2586 EBE=      -3.603353E+01 WEIGHT=    1.138730D+00 (bending)
2587 ESC=       4.265332E+01 WEIGHT=    1.625800D-01 (SC local)
2588 ETORS=     7.397902E+00 WEIGHT=    1.985990D+00 (torsional)
2589 ETORSD=   -2.708645E+00 WEIGHT=    1.570690D+00 (double torsional)
2590 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2591 ECORR4=   -5.377590E+01 WEIGHT=    4.288700D-01 (multi-body)
2592 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2593 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2594 EELLO=     5.479509E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
2595 ETURN3=    1.506095E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2596 ETURN4=    9.441086E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
2597 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2598 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2599 EDIHC=     0.000000E+00 (dihedral angle constraints)
2600 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2601 UCONST=     0.000000E+00 (Constraint energy)
2602 EDFAD=     5.491269-315 (DFA distance energy)
2603 EDFAT=     6.953158-310 (DFA torsion energy)
2604 EDFAN=     6.953158-310 (DFA NCa energy)
2605 EDFAB=     2.650815-317 (DFA Beta energy)
2606 ETOT=     -8.429742E+01 (total)
2607 RMS deviation from the reference structure:   4.907
2608  % of native contacts:  33.333
2609  % of nonnative contacts:  77.778
2610  contact order:   0.399
2611  TM-score with the reference structure:     0.29
2612  Conformation #          69  read
2613
2614
2615  Conformation #          62  sumsl return code            4
2616
2617 Virtual-chain energies:
2618
2619 EVDW=     -5.057064E+01 WEIGHT=    1.352790D+00 (SC-SC)
2620 EVDW2=     4.074661E+01 WEIGHT=    1.593040D+00 (SC-p)
2621 EES=      -8.577540E+01 WEIGHT=    7.153400D-01 (p-p)
2622 EVDWPP=   -1.142730E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2623 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2624 EBE=      -3.529805E+01 WEIGHT=    1.138730D+00 (bending)
2625 ESC=       3.135663E+01 WEIGHT=    1.625800D-01 (SC local)
2626 ETORS=     8.106742E+00 WEIGHT=    1.985990D+00 (torsional)
2627 ETORSD=   -3.708433E-01 WEIGHT=    1.570690D+00 (double torsional)
2628 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2629 ECORR4=   -5.984167E+01 WEIGHT=    4.288700D-01 (multi-body)
2630 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2631 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2632 EELLO=     3.690159E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2633 ETURN3=    1.699486E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2634 ETURN4=   -3.680174E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2635 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2636 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2637 EDIHC=     0.000000E+00 (dihedral angle constraints)
2638 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2639 UCONST=     0.000000E+00 (Constraint energy)
2640 EDFAD=     5.491269-315 (DFA distance energy)
2641 EDFAT=     6.953158-310 (DFA torsion energy)
2642 EDFAN=     6.953158-310 (DFA NCa energy)
2643 EDFAB=     2.650815-317 (DFA Beta energy)
2644 ETOT=     -8.457385E+01 (total)
2645 RMS deviation from the reference structure:   4.729
2646  % of native contacts:  16.667
2647  % of nonnative contacts:  87.500
2648  contact order:   0.398
2649  TM-score with the reference structure:     0.31
2650  Conformation #          70  read
2651
2652
2653  Conformation #          67  sumsl return code            4
2654
2655 Virtual-chain energies:
2656
2657 EVDW=     -5.455168E+01 WEIGHT=    1.352790D+00 (SC-SC)
2658 EVDW2=     5.219747E+01 WEIGHT=    1.593040D+00 (SC-p)
2659 EES=      -1.050905E+02 WEIGHT=    7.153400D-01 (p-p)
2660 EVDWPP=   -2.381681E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2661 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2662 EBE=      -3.878552E+01 WEIGHT=    1.138730D+00 (bending)
2663 ESC=       4.519645E+01 WEIGHT=    1.625800D-01 (SC local)
2664 ETORS=     9.338368E+00 WEIGHT=    1.985990D+00 (torsional)
2665 ETORSD=    3.081421E-01 WEIGHT=    1.570690D+00 (double torsional)
2666 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2667 ECORR4=   -7.962151E+01 WEIGHT=    4.288700D-01 (multi-body)
2668 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2669 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2670 EELLO=    -5.479811E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2671 ETURN3=    1.881440E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2672 ETURN4=   -2.180121E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2673 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2674 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2675 EDIHC=     0.000000E+00 (dihedral angle constraints)
2676 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2677 UCONST=     0.000000E+00 (Constraint energy)
2678 EDFAD=     5.491269-315 (DFA distance energy)
2679 EDFAT=     6.953158-310 (DFA torsion energy)
2680 EDFAN=     6.953158-310 (DFA NCa energy)
2681 EDFAB=     2.650815-317 (DFA Beta energy)
2682 ETOT=     -9.104212E+01 (total)
2683 RMS deviation from the reference structure:   3.058
2684  % of native contacts:  58.333
2685  % of nonnative contacts:  68.182
2686  contact order:   0.279
2687  TM-score with the reference structure:     0.30
2688  Conformation #          71  read
2689
2690
2691  Conformation #          63  sumsl return code            4
2692
2693 Virtual-chain energies:
2694
2695 EVDW=     -4.838675E+01 WEIGHT=    1.352790D+00 (SC-SC)
2696 EVDW2=     5.329709E+01 WEIGHT=    1.593040D+00 (SC-p)
2697 EES=      -1.156802E+02 WEIGHT=    7.153400D-01 (p-p)
2698 EVDWPP=   -1.743391E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2699 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2700 EBE=      -4.220411E+01 WEIGHT=    1.138730D+00 (bending)
2701 ESC=       3.582485E+01 WEIGHT=    1.625800D-01 (SC local)
2702 ETORS=     1.225123E+01 WEIGHT=    1.985990D+00 (torsional)
2703 ETORSD=    4.195183E-01 WEIGHT=    1.570690D+00 (double torsional)
2704 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2705 ECORR4=   -8.224275E+01 WEIGHT=    4.288700D-01 (multi-body)
2706 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2707 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2708 EELLO=    -1.075349E+01 WEIGHT=    1.603600D-01 (electrostatic-local)
2709 ETURN3=    1.969166E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2710 ETURN4=    9.440083E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2711 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2712 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2713 EDIHC=     0.000000E+00 (dihedral angle constraints)
2714 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2715 UCONST=     0.000000E+00 (Constraint energy)
2716 EDFAD=     5.491269-315 (DFA distance energy)
2717 EDFAT=     6.953158-310 (DFA torsion energy)
2718 EDFAN=     6.953158-310 (DFA NCa energy)
2719 EDFAB=     2.650815-317 (DFA Beta energy)
2720 ETOT=     -8.567723E+01 (total)
2721 RMS deviation from the reference structure:   3.888
2722  % of native contacts:  50.000
2723  % of nonnative contacts:  71.429
2724  contact order:   0.323
2725  TM-score with the reference structure:     0.32
2726  Conformation #          72  read
2727
2728
2729  Conformation #          71  sumsl return code            4
2730
2731 Virtual-chain energies:
2732
2733 EVDW=     -4.955611E+01 WEIGHT=    1.352790D+00 (SC-SC)
2734 EVDW2=     4.930650E+01 WEIGHT=    1.593040D+00 (SC-p)
2735 EES=      -9.298890E+01 WEIGHT=    7.153400D-01 (p-p)
2736 EVDWPP=   -2.833676E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2737 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2738 EBE=      -4.043403E+01 WEIGHT=    1.138730D+00 (bending)
2739 ESC=       2.435709E+01 WEIGHT=    1.625800D-01 (SC local)
2740 ETORS=     1.041503E+01 WEIGHT=    1.985990D+00 (torsional)
2741 ETORSD=   -2.684490E+00 WEIGHT=    1.570690D+00 (double torsional)
2742 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2743 ECORR4=   -7.150136E+01 WEIGHT=    4.288700D-01 (multi-body)
2744 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2745 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2746 EELLO=    -5.720917E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2747 ETURN3=    1.743149E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2748 ETURN4=    1.804284E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2749 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2750 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2751 EDIHC=     0.000000E+00 (dihedral angle constraints)
2752 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2753 UCONST=     0.000000E+00 (Constraint energy)
2754 EDFAD=     5.491269-315 (DFA distance energy)
2755 EDFAT=     6.953158-310 (DFA torsion energy)
2756 EDFAN=     6.953158-310 (DFA NCa energy)
2757 EDFAB=     2.650815-317 (DFA Beta energy)
2758 ETOT=     -8.482491E+01 (total)
2759 RMS deviation from the reference structure:   3.837
2760  % of native contacts:  50.000
2761  % of nonnative contacts:  68.421
2762  contact order:   0.278
2763  TM-score with the reference structure:     0.33
2764  Conformation #          73  read
2765
2766
2767  Conformation #          66  sumsl return code            4
2768
2769 Virtual-chain energies:
2770
2771 EVDW=     -5.558862E+01 WEIGHT=    1.352790D+00 (SC-SC)
2772 EVDW2=     4.099564E+01 WEIGHT=    1.593040D+00 (SC-p)
2773 EES=      -7.263991E+01 WEIGHT=    7.153400D-01 (p-p)
2774 EVDWPP=   -2.871983E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2775 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2776 EBE=      -3.983438E+01 WEIGHT=    1.138730D+00 (bending)
2777 ESC=       4.878720E+01 WEIGHT=    1.625800D-01 (SC local)
2778 ETORS=     1.077193E+01 WEIGHT=    1.985990D+00 (torsional)
2779 ETORSD=   -2.090169E-01 WEIGHT=    1.570690D+00 (double torsional)
2780 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2781 ECORR4=   -4.736706E+01 WEIGHT=    4.288700D-01 (multi-body)
2782 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2783 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2784 EELLO=     3.065615E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2785 ETURN3=    1.303590E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2786 ETURN4=   -7.783258E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2787 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2788 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2789 EDIHC=     0.000000E+00 (dihedral angle constraints)
2790 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2791 UCONST=     0.000000E+00 (Constraint energy)
2792 EDFAD=     5.491269-315 (DFA distance energy)
2793 EDFAT=     6.953158-310 (DFA torsion energy)
2794 EDFAN=     6.953158-310 (DFA NCa energy)
2795 EDFAB=     2.650815-317 (DFA Beta energy)
2796 ETOT=     -8.446727E+01 (total)
2797 RMS deviation from the reference structure:   4.248
2798  % of native contacts:  25.000
2799  % of nonnative contacts:  80.000
2800  contact order:   0.355
2801  TM-score with the reference structure:     0.26
2802  Conformation #          74  read
2803
2804
2805  Conformation #          73  sumsl return code            4
2806
2807 Virtual-chain energies:
2808
2809 EVDW=     -5.070442E+01 WEIGHT=    1.352790D+00 (SC-SC)
2810 EVDW2=     3.873356E+01 WEIGHT=    1.593040D+00 (SC-p)
2811 EES=      -7.528914E+01 WEIGHT=    7.153400D-01 (p-p)
2812 EVDWPP=   -1.629209E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2813 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2814 EBE=      -3.705370E+01 WEIGHT=    1.138730D+00 (bending)
2815 ESC=       4.089260E+01 WEIGHT=    1.625800D-01 (SC local)
2816 ETORS=     8.532795E+00 WEIGHT=    1.985990D+00 (torsional)
2817 ETORSD=   -1.191087E+00 WEIGHT=    1.570690D+00 (double torsional)
2818 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2819 ECORR4=   -5.469123E+01 WEIGHT=    4.288700D-01 (multi-body)
2820 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2821 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2822 EELLO=     3.129515E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2823 ETURN3=    1.442443E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2824 ETURN4=   -3.119318E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2825 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2826 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2827 EDIHC=     0.000000E+00 (dihedral angle constraints)
2828 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2829 UCONST=     0.000000E+00 (Constraint energy)
2830 EDFAD=     5.491269-315 (DFA distance energy)
2831 EDFAT=     6.953158-310 (DFA torsion energy)
2832 EDFAN=     6.953158-310 (DFA NCa energy)
2833 EDFAB=     2.650815-317 (DFA Beta energy)
2834 ETOT=     -8.375117E+01 (total)
2835 RMS deviation from the reference structure:   4.797
2836  % of native contacts:  25.000
2837  % of nonnative contacts:  83.333
2838  contact order:   0.449
2839  TM-score with the reference structure:     0.28
2840  Conformation #          75  read
2841
2842
2843  Conformation #          68  sumsl return code            4
2844
2845 Virtual-chain energies:
2846
2847 EVDW=     -5.185202E+01 WEIGHT=    1.352790D+00 (SC-SC)
2848 EVDW2=     4.306902E+01 WEIGHT=    1.593040D+00 (SC-p)
2849 EES=      -7.142382E+01 WEIGHT=    7.153400D-01 (p-p)
2850 EVDWPP=   -4.068427E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2851 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2852 EBE=      -3.737453E+01 WEIGHT=    1.138730D+00 (bending)
2853 ESC=       3.911609E+01 WEIGHT=    1.625800D-01 (SC local)
2854 ETORS=     7.209737E+00 WEIGHT=    1.985990D+00 (torsional)
2855 ETORSD=   -1.672418E+00 WEIGHT=    1.570690D+00 (double torsional)
2856 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2857 ECORR4=   -5.441112E+01 WEIGHT=    4.288700D-01 (multi-body)
2858 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2859 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2860 EELLO=    -2.262242E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2861 ETURN3=    1.274248E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2862 ETURN4=    4.334053E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
2863 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2864 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2865 EDIHC=     0.000000E+00 (dihedral angle constraints)
2866 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2867 UCONST=     0.000000E+00 (Constraint energy)
2868 EDFAD=     5.491269-315 (DFA distance energy)
2869 EDFAT=     6.953158-310 (DFA torsion energy)
2870 EDFAN=     6.953158-310 (DFA NCa energy)
2871 EDFAB=     2.650815-317 (DFA Beta energy)
2872 ETOT=     -8.367279E+01 (total)
2873 RMS deviation from the reference structure:   3.393
2874  % of native contacts:  41.667
2875  % of nonnative contacts:  78.261
2876  contact order:   0.403
2877  TM-score with the reference structure:     0.25
2878  Conformation #          76  read
2879
2880
2881  Conformation #          70  sumsl return code            4
2882
2883 Virtual-chain energies:
2884
2885 EVDW=     -4.941332E+01 WEIGHT=    1.352790D+00 (SC-SC)
2886 EVDW2=     4.327549E+01 WEIGHT=    1.593040D+00 (SC-p)
2887 EES=      -7.973914E+01 WEIGHT=    7.153400D-01 (p-p)
2888 EVDWPP=   -3.224179E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2889 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2890 EBE=      -3.907734E+01 WEIGHT=    1.138730D+00 (bending)
2891 ESC=       3.175026E+01 WEIGHT=    1.625800D-01 (SC local)
2892 ETORS=     1.108134E+01 WEIGHT=    1.985990D+00 (torsional)
2893 ETORSD=   -3.746853E+00 WEIGHT=    1.570690D+00 (double torsional)
2894 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2895 ECORR4=   -6.063216E+01 WEIGHT=    4.288700D-01 (multi-body)
2896 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2897 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2898 EELLO=    -1.044895E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2899 ETURN3=    1.277766E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2900 ETURN4=    1.359596E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2901 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2902 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2903 EDIHC=     0.000000E+00 (dihedral angle constraints)
2904 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2905 UCONST=     0.000000E+00 (Constraint energy)
2906 EDFAD=     5.491269-315 (DFA distance energy)
2907 EDFAT=     6.953158-310 (DFA torsion energy)
2908 EDFAN=     6.953158-310 (DFA NCa energy)
2909 EDFAB=     2.650815-317 (DFA Beta energy)
2910 ETOT=     -8.553904E+01 (total)
2911 RMS deviation from the reference structure:   4.457
2912  % of native contacts:  33.333
2913  % of nonnative contacts:  80.000
2914  contact order:   0.343
2915  TM-score with the reference structure:     0.32
2916  Conformation #          77  read
2917
2918
2919  Conformation #          75  sumsl return code            4
2920
2921 Virtual-chain energies:
2922
2923 EVDW=     -5.092030E+01 WEIGHT=    1.352790D+00 (SC-SC)
2924 EVDW2=     4.785689E+01 WEIGHT=    1.593040D+00 (SC-p)
2925 EES=      -9.703989E+01 WEIGHT=    7.153400D-01 (p-p)
2926 EVDWPP=   -2.112290E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2927 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2928 EBE=      -4.155311E+01 WEIGHT=    1.138730D+00 (bending)
2929 ESC=       4.015582E+01 WEIGHT=    1.625800D-01 (SC local)
2930 ETORS=     1.117221E+01 WEIGHT=    1.985990D+00 (torsional)
2931 ETORSD=   -2.062745E+00 WEIGHT=    1.570690D+00 (double torsional)
2932 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2933 ECORR4=   -7.085881E+01 WEIGHT=    4.288700D-01 (multi-body)
2934 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2935 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2936 EELLO=    -1.861471E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
2937 ETURN3=    1.888590E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2938 ETURN4=   -2.256480E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2939 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2940 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2941 EDIHC=     0.000000E+00 (dihedral angle constraints)
2942 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2943 UCONST=     0.000000E+00 (Constraint energy)
2944 EDFAD=     5.491269-315 (DFA distance energy)
2945 EDFAT=     6.953158-310 (DFA torsion energy)
2946 EDFAN=     6.953158-310 (DFA NCa energy)
2947 EDFAB=     2.650815-317 (DFA Beta energy)
2948 ETOT=     -8.662372E+01 (total)
2949 RMS deviation from the reference structure:   3.111
2950  % of native contacts:  25.000
2951  % of nonnative contacts:  82.353
2952  contact order:   0.345
2953  TM-score with the reference structure:     0.30
2954  Conformation #          78  read
2955
2956
2957  Conformation #          72  sumsl return code            4
2958
2959 Virtual-chain energies:
2960
2961 EVDW=     -5.202642E+01 WEIGHT=    1.352790D+00 (SC-SC)
2962 EVDW2=     3.719718E+01 WEIGHT=    1.593040D+00 (SC-p)
2963 EES=      -6.632733E+01 WEIGHT=    7.153400D-01 (p-p)
2964 EVDWPP=   -2.983163E+01 WEIGHT=    1.137100D-01 (p-p VDW)
2965 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
2966 EBE=      -3.708483E+01 WEIGHT=    1.138730D+00 (bending)
2967 ESC=       3.442534E+01 WEIGHT=    1.625800D-01 (SC local)
2968 ETORS=     5.991446E+00 WEIGHT=    1.985990D+00 (torsional)
2969 ETORSD=   -8.175710E-01 WEIGHT=    1.570690D+00 (double torsional)
2970 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
2971 ECORR4=   -4.825685E+01 WEIGHT=    4.288700D-01 (multi-body)
2972 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2973 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
2974 EELLO=    -7.114080E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
2975 ETURN3=    1.436691E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
2976 ETURN4=   -1.579530E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
2977 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
2978 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
2979 EDIHC=     0.000000E+00 (dihedral angle constraints)
2980 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
2981 UCONST=     0.000000E+00 (Constraint energy)
2982 EDFAD=     5.491269-315 (DFA distance energy)
2983 EDFAT=     6.953158-310 (DFA torsion energy)
2984 EDFAN=     6.953158-310 (DFA NCa energy)
2985 EDFAB=     2.650815-317 (DFA Beta energy)
2986 ETOT=     -8.559688E+01 (total)
2987 RMS deviation from the reference structure:   4.213
2988  % of native contacts:  33.333
2989  % of nonnative contacts:  78.947
2990  contact order:   0.380
2991  TM-score with the reference structure:     0.29
2992  Conformation #          79  read
2993
2994
2995  Conformation #          77  sumsl return code            4
2996
2997 Virtual-chain energies:
2998
2999 EVDW=     -5.270228E+01 WEIGHT=    1.352790D+00 (SC-SC)
3000 EVDW2=     5.502728E+01 WEIGHT=    1.593040D+00 (SC-p)
3001 EES=      -1.136852E+02 WEIGHT=    7.153400D-01 (p-p)
3002 EVDWPP=   -1.504331E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3003 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3004 EBE=      -4.093744E+01 WEIGHT=    1.138730D+00 (bending)
3005 ESC=       3.996051E+01 WEIGHT=    1.625800D-01 (SC local)
3006 ETORS=     1.458986E+01 WEIGHT=    1.985990D+00 (torsional)
3007 ETORSD=   -1.929067E+00 WEIGHT=    1.570690D+00 (double torsional)
3008 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3009 ECORR4=   -8.308958E+01 WEIGHT=    4.288700D-01 (multi-body)
3010 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3011 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3012 EELLO=    -1.665224E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3013 ETURN3=    1.893201E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3014 ETURN4=   -1.541986E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
3015 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3016 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3017 EDIHC=     0.000000E+00 (dihedral angle constraints)
3018 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3019 UCONST=     0.000000E+00 (Constraint energy)
3020 EDFAD=     5.491269-315 (DFA distance energy)
3021 EDFAT=     6.953158-310 (DFA torsion energy)
3022 EDFAN=     6.953158-310 (DFA NCa energy)
3023 EDFAB=     2.650815-317 (DFA Beta energy)
3024 ETOT=     -8.490451E+01 (total)
3025 RMS deviation from the reference structure:   3.061
3026  % of native contacts:  58.333
3027  % of nonnative contacts:  69.565
3028  contact order:   0.370
3029  TM-score with the reference structure:     0.31
3030  Conformation #          80  read
3031
3032
3033  Conformation #          79  sumsl return code            4
3034
3035 Virtual-chain energies:
3036
3037 EVDW=     -5.341258E+01 WEIGHT=    1.352790D+00 (SC-SC)
3038 EVDW2=     5.243747E+01 WEIGHT=    1.593040D+00 (SC-p)
3039 EES=      -1.050399E+02 WEIGHT=    7.153400D-01 (p-p)
3040 EVDWPP=   -2.565287E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3041 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3042 EBE=      -3.714976E+01 WEIGHT=    1.138730D+00 (bending)
3043 ESC=       4.875607E+01 WEIGHT=    1.625800D-01 (SC local)
3044 ETORS=     8.727249E+00 WEIGHT=    1.985990D+00 (torsional)
3045 ETORSD=   -4.808561E-01 WEIGHT=    1.570690D+00 (double torsional)
3046 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3047 ECORR4=   -7.774905E+01 WEIGHT=    4.288700D-01 (multi-body)
3048 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3049 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3050 EELLO=    -6.233475E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3051 ETURN3=    1.861225E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3052 ETURN4=   -3.151985E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3053 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3054 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3055 EDIHC=     0.000000E+00 (dihedral angle constraints)
3056 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3057 UCONST=     0.000000E+00 (Constraint energy)
3058 EDFAD=     5.491269-315 (DFA distance energy)
3059 EDFAT=     6.953158-310 (DFA torsion energy)
3060 EDFAN=     6.953158-310 (DFA NCa energy)
3061 EDFAB=     2.650815-317 (DFA Beta energy)
3062 ETOT=     -8.960553E+01 (total)
3063 RMS deviation from the reference structure:   2.212
3064  % of native contacts:  66.667
3065  % of nonnative contacts:  60.000
3066  contact order:   0.314
3067  TM-score with the reference structure:     0.31
3068  Conformation #          81  read
3069
3070
3071  Conformation #          80  sumsl return code            4
3072
3073 Virtual-chain energies:
3074
3075 EVDW=     -5.034280E+01 WEIGHT=    1.352790D+00 (SC-SC)
3076 EVDW2=     4.944940E+01 WEIGHT=    1.593040D+00 (SC-p)
3077 EES=      -1.039191E+02 WEIGHT=    7.153400D-01 (p-p)
3078 EVDWPP=   -1.890786E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3079 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3080 EBE=      -4.181616E+01 WEIGHT=    1.138730D+00 (bending)
3081 ESC=       4.984295E+01 WEIGHT=    1.625800D-01 (SC local)
3082 ETORS=     1.106015E+01 WEIGHT=    1.985990D+00 (torsional)
3083 ETORSD=    1.023298E+00 WEIGHT=    1.570690D+00 (double torsional)
3084 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3085 ECORR4=   -7.323080E+01 WEIGHT=    4.288700D-01 (multi-body)
3086 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3087 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3088 EELLO=    -9.436675E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
3089 ETURN3=    1.777731E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3090 ETURN4=   -3.457531E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3091 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3092 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3093 EDIHC=     0.000000E+00 (dihedral angle constraints)
3094 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3095 UCONST=     0.000000E+00 (Constraint energy)
3096 EDFAD=     5.491269-315 (DFA distance energy)
3097 EDFAT=     6.953158-310 (DFA torsion energy)
3098 EDFAN=     6.953158-310 (DFA NCa energy)
3099 EDFAB=     2.650815-317 (DFA Beta energy)
3100 ETOT=     -8.561058E+01 (total)
3101 RMS deviation from the reference structure:   4.041
3102  % of native contacts:  33.333
3103  % of nonnative contacts:  80.000
3104  contact order:   0.261
3105  TM-score with the reference structure:     0.31
3106  Conformation #          82  read
3107
3108
3109  Conformation #          34  sumsl return code            4
3110
3111 Virtual-chain energies:
3112
3113 EVDW=     -5.327677E+01 WEIGHT=    1.352790D+00 (SC-SC)
3114 EVDW2=     4.785569E+01 WEIGHT=    1.593040D+00 (SC-p)
3115 EES=      -9.408768E+01 WEIGHT=    7.153400D-01 (p-p)
3116 EVDWPP=   -3.013096E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3117 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3118 EBE=      -3.638280E+01 WEIGHT=    1.138730D+00 (bending)
3119 ESC=       3.624299E+01 WEIGHT=    1.625800D-01 (SC local)
3120 ETORS=     8.782741E+00 WEIGHT=    1.985990D+00 (torsional)
3121 ETORSD=    6.159791E-02 WEIGHT=    1.570690D+00 (double torsional)
3122 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3123 ECORR4=   -7.185862E+01 WEIGHT=    4.288700D-01 (multi-body)
3124 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3125 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3126 EELLO=    -7.298110E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3127 ETURN3=    1.723138E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3128 ETURN4=   -2.151824E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
3129 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3130 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3131 EDIHC=     0.000000E+00 (dihedral angle constraints)
3132 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3133 UCONST=     0.000000E+00 (Constraint energy)
3134 EDFAD=     5.491269-315 (DFA distance energy)
3135 EDFAT=     6.953158-310 (DFA torsion energy)
3136 EDFAN=     6.953158-310 (DFA NCa energy)
3137 EDFAB=     2.650815-317 (DFA Beta energy)
3138 ETOT=     -8.762345E+01 (total)
3139 RMS deviation from the reference structure:   3.373
3140  % of native contacts:  50.000
3141  % of nonnative contacts:  73.913
3142  contact order:   0.318
3143  TM-score with the reference structure:     0.32
3144  Conformation #          83  read
3145
3146
3147  Conformation #          78  sumsl return code            4
3148
3149 Virtual-chain energies:
3150
3151 EVDW=     -5.259873E+01 WEIGHT=    1.352790D+00 (SC-SC)
3152 EVDW2=     4.539096E+01 WEIGHT=    1.593040D+00 (SC-p)
3153 EES=      -9.292482E+01 WEIGHT=    7.153400D-01 (p-p)
3154 EVDWPP=   -2.530713E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3155 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3156 EBE=      -4.174051E+01 WEIGHT=    1.138730D+00 (bending)
3157 ESC=       4.192592E+01 WEIGHT=    1.625800D-01 (SC local)
3158 ETORS=     1.110695E+01 WEIGHT=    1.985990D+00 (torsional)
3159 ETORSD=   -9.768233E-02 WEIGHT=    1.570690D+00 (double torsional)
3160 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3161 ECORR4=   -6.361707E+01 WEIGHT=    4.288700D-01 (multi-body)
3162 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3163 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3164 EELLO=    -4.792713E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3165 ETURN3=    1.655658E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3166 ETURN4=    2.321222E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3167 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3168 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3169 EDIHC=     0.000000E+00 (dihedral angle constraints)
3170 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3171 UCONST=     0.000000E+00 (Constraint energy)
3172 EDFAD=     5.491269-315 (DFA distance energy)
3173 EDFAT=     6.953158-310 (DFA torsion energy)
3174 EDFAN=     6.953158-310 (DFA NCa energy)
3175 EDFAB=     2.650815-317 (DFA Beta energy)
3176 ETOT=     -8.558602E+01 (total)
3177 RMS deviation from the reference structure:   3.730
3178  % of native contacts:  41.667
3179  % of nonnative contacts:  76.190
3180  contact order:   0.312
3181  TM-score with the reference structure:     0.27
3182  Conformation #          84  read
3183
3184
3185  Conformation #          83  sumsl return code            4
3186
3187 Virtual-chain energies:
3188
3189 EVDW=     -4.967079E+01 WEIGHT=    1.352790D+00 (SC-SC)
3190 EVDW2=     4.575443E+01 WEIGHT=    1.593040D+00 (SC-p)
3191 EES=      -9.058588E+01 WEIGHT=    7.153400D-01 (p-p)
3192 EVDWPP=   -1.802426E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3193 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3194 EBE=      -3.814456E+01 WEIGHT=    1.138730D+00 (bending)
3195 ESC=       3.798496E+01 WEIGHT=    1.625800D-01 (SC local)
3196 ETORS=     8.347573E+00 WEIGHT=    1.985990D+00 (torsional)
3197 ETORSD=   -2.343764E+00 WEIGHT=    1.570690D+00 (double torsional)
3198 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3199 ECORR4=   -6.813979E+01 WEIGHT=    4.288700D-01 (multi-body)
3200 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3201 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3202 EELLO=    -4.057028E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3203 ETURN3=    1.857192E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3204 ETURN4=   -1.560471E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3205 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3206 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3207 EDIHC=     0.000000E+00 (dihedral angle constraints)
3208 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3209 UCONST=     0.000000E+00 (Constraint energy)
3210 EDFAD=     5.491269-315 (DFA distance energy)
3211 EDFAT=     6.953158-310 (DFA torsion energy)
3212 EDFAN=     6.953158-310 (DFA NCa energy)
3213 EDFAB=     2.650815-317 (DFA Beta energy)
3214 ETOT=     -8.509093E+01 (total)
3215 RMS deviation from the reference structure:   6.810
3216  % of native contacts:  25.000
3217  % of nonnative contacts:  83.333
3218  contact order:   0.255
3219  TM-score with the reference structure:     0.29
3220  Conformation #          85  read
3221
3222
3223  Conformation #          82  sumsl return code            4
3224
3225 Virtual-chain energies:
3226
3227 EVDW=     -5.396731E+01 WEIGHT=    1.352790D+00 (SC-SC)
3228 EVDW2=     5.114525E+01 WEIGHT=    1.593040D+00 (SC-p)
3229 EES=      -1.000224E+02 WEIGHT=    7.153400D-01 (p-p)
3230 EVDWPP=   -2.232399E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3231 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3232 EBE=      -3.899427E+01 WEIGHT=    1.138730D+00 (bending)
3233 ESC=       6.074529E+01 WEIGHT=    1.625800D-01 (SC local)
3234 ETORS=     8.985932E+00 WEIGHT=    1.985990D+00 (torsional)
3235 ETORSD=   -1.963411E+00 WEIGHT=    1.570690D+00 (double torsional)
3236 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3237 ECORR4=   -7.628854E+01 WEIGHT=    4.288700D-01 (multi-body)
3238 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3239 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3240 EELLO=     2.874693E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3241 ETURN3=    1.922625E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3242 ETURN4=   -1.775780E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3243 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3244 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3245 EDIHC=     0.000000E+00 (dihedral angle constraints)
3246 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3247 UCONST=     0.000000E+00 (Constraint energy)
3248 EDFAD=     5.491269-315 (DFA distance energy)
3249 EDFAT=     6.953158-310 (DFA torsion energy)
3250 EDFAN=     6.953158-310 (DFA NCa energy)
3251 EDFAB=     2.650815-317 (DFA Beta energy)
3252 ETOT=     -8.637846E+01 (total)
3253 RMS deviation from the reference structure:   5.517
3254  % of native contacts:  33.333
3255  % of nonnative contacts:  80.000
3256  contact order:   0.230
3257  TM-score with the reference structure:     0.29
3258  Conformation #          86  read
3259
3260
3261  Conformation #          85  sumsl return code            4
3262
3263 Virtual-chain energies:
3264
3265 EVDW=     -5.496483E+01 WEIGHT=    1.352790D+00 (SC-SC)
3266 EVDW2=     4.737495E+01 WEIGHT=    1.593040D+00 (SC-p)
3267 EES=      -8.628896E+01 WEIGHT=    7.153400D-01 (p-p)
3268 EVDWPP=   -3.645443E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3269 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3270 EBE=      -3.798831E+01 WEIGHT=    1.138730D+00 (bending)
3271 ESC=       4.645872E+01 WEIGHT=    1.625800D-01 (SC local)
3272 ETORS=     1.100794E+01 WEIGHT=    1.985990D+00 (torsional)
3273 ETORSD=   -4.124845E+00 WEIGHT=    1.570690D+00 (double torsional)
3274 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3275 ECORR4=   -6.695107E+01 WEIGHT=    4.288700D-01 (multi-body)
3276 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3277 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3278 EELLO=    -2.140425E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3279 ETURN3=    1.548896E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3280 ETURN4=    3.138638E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3281 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3282 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3283 EDIHC=     0.000000E+00 (dihedral angle constraints)
3284 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3285 UCONST=     0.000000E+00 (Constraint energy)
3286 EDFAD=     5.491269-315 (DFA distance energy)
3287 EDFAT=     6.953158-310 (DFA torsion energy)
3288 EDFAN=     6.953158-310 (DFA NCa energy)
3289 EDFAB=     2.650815-317 (DFA Beta energy)
3290 ETOT=     -8.592375E+01 (total)
3291 RMS deviation from the reference structure:   3.788
3292  % of native contacts:  41.667
3293  % of nonnative contacts:  78.261
3294  contact order:   0.312
3295  TM-score with the reference structure:     0.25
3296  Conformation #          87  read
3297
3298
3299  Conformation #          86  sumsl return code            4
3300
3301 Virtual-chain energies:
3302
3303 EVDW=     -5.151675E+01 WEIGHT=    1.352790D+00 (SC-SC)
3304 EVDW2=     5.153825E+01 WEIGHT=    1.593040D+00 (SC-p)
3305 EES=      -1.001696E+02 WEIGHT=    7.153400D-01 (p-p)
3306 EVDWPP=   -2.837889E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3307 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3308 EBE=      -3.828980E+01 WEIGHT=    1.138730D+00 (bending)
3309 ESC=       3.395919E+01 WEIGHT=    1.625800D-01 (SC local)
3310 ETORS=     8.660517E+00 WEIGHT=    1.985990D+00 (torsional)
3311 ETORSD=    1.218463E+00 WEIGHT=    1.570690D+00 (double torsional)
3312 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3313 ECORR4=   -7.406717E+01 WEIGHT=    4.288700D-01 (multi-body)
3314 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3315 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3316 EELLO=    -5.610724E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3317 ETURN3=    1.647882E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3318 ETURN4=   -4.451240E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3319 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3320 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3321 EDIHC=     0.000000E+00 (dihedral angle constraints)
3322 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3323 UCONST=     0.000000E+00 (Constraint energy)
3324 EDFAD=     5.491269-315 (DFA distance energy)
3325 EDFAT=     6.953158-310 (DFA torsion energy)
3326 EDFAN=     6.953158-310 (DFA NCa energy)
3327 EDFAB=     2.650815-317 (DFA Beta energy)
3328 ETOT=     -8.924784E+01 (total)
3329 RMS deviation from the reference structure:   3.027
3330  % of native contacts:  41.667
3331  % of nonnative contacts:  76.190
3332  contact order:   0.323
3333  TM-score with the reference structure:     0.32
3334  Conformation #          88  read
3335
3336
3337  Conformation #          84  sumsl return code            4
3338
3339 Virtual-chain energies:
3340
3341 EVDW=     -5.383932E+01 WEIGHT=    1.352790D+00 (SC-SC)
3342 EVDW2=     5.041252E+01 WEIGHT=    1.593040D+00 (SC-p)
3343 EES=      -1.015163E+02 WEIGHT=    7.153400D-01 (p-p)
3344 EVDWPP=   -2.501080E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3345 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3346 EBE=      -3.771459E+01 WEIGHT=    1.138730D+00 (bending)
3347 ESC=       5.189949E+01 WEIGHT=    1.625800D-01 (SC local)
3348 ETORS=     8.859283E+00 WEIGHT=    1.985990D+00 (torsional)
3349 ETORSD=   -4.275785E-01 WEIGHT=    1.570690D+00 (double torsional)
3350 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3351 ECORR4=   -7.620882E+01 WEIGHT=    4.288700D-01 (multi-body)
3352 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3353 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3354 EELLO=    -4.821388E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3355 ETURN3=    1.794374E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3356 ETURN4=   -3.240153E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3357 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3358 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3359 EDIHC=     0.000000E+00 (dihedral angle constraints)
3360 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3361 UCONST=     0.000000E+00 (Constraint energy)
3362 EDFAD=     5.491269-315 (DFA distance energy)
3363 EDFAT=     6.953158-310 (DFA torsion energy)
3364 EDFAN=     6.953158-310 (DFA NCa energy)
3365 EDFAB=     2.650815-317 (DFA Beta energy)
3366 ETOT=     -9.090063E+01 (total)
3367 RMS deviation from the reference structure:   2.049
3368  % of native contacts:  75.000
3369  % of nonnative contacts:  57.143
3370  contact order:   0.314
3371  TM-score with the reference structure:     0.31
3372  Conformation #          89  read
3373
3374
3375  Conformation #          88  sumsl return code            4
3376
3377 Virtual-chain energies:
3378
3379 EVDW=     -5.659903E+01 WEIGHT=    1.352790D+00 (SC-SC)
3380 EVDW2=     5.510575E+01 WEIGHT=    1.593040D+00 (SC-p)
3381 EES=      -1.109343E+02 WEIGHT=    7.153400D-01 (p-p)
3382 EVDWPP=   -2.466897E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3383 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3384 EBE=      -3.977390E+01 WEIGHT=    1.138730D+00 (bending)
3385 ESC=       4.986767E+01 WEIGHT=    1.625800D-01 (SC local)
3386 ETORS=     1.305861E+01 WEIGHT=    1.985990D+00 (torsional)
3387 ETORSD=   -1.570175E+00 WEIGHT=    1.570690D+00 (double torsional)
3388 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3389 ECORR4=   -8.425735E+01 WEIGHT=    4.288700D-01 (multi-body)
3390 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3391 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3392 EELLO=    -2.296543E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3393 ETURN3=    1.984228E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3394 ETURN4=   -5.540303E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
3395 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3396 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3397 EDIHC=     0.000000E+00 (dihedral angle constraints)
3398 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3399 UCONST=     0.000000E+00 (Constraint energy)
3400 EDFAD=     5.491269-315 (DFA distance energy)
3401 EDFAT=     6.953158-310 (DFA torsion energy)
3402 EDFAN=     6.953158-310 (DFA NCa energy)
3403 EDFAB=     2.650815-317 (DFA Beta energy)
3404 ETOT=     -8.805042E+01 (total)
3405 RMS deviation from the reference structure:   2.700
3406  % of native contacts:  50.000
3407  % of nonnative contacts:  70.000
3408  contact order:   0.332
3409  TM-score with the reference structure:     0.30
3410  Conformation #          90  read
3411
3412
3413  Conformation #          87  sumsl return code            4
3414
3415 Virtual-chain energies:
3416
3417 EVDW=     -5.210634E+01 WEIGHT=    1.352790D+00 (SC-SC)
3418 EVDW2=     4.846949E+01 WEIGHT=    1.593040D+00 (SC-p)
3419 EES=      -9.843086E+01 WEIGHT=    7.153400D-01 (p-p)
3420 EVDWPP=   -2.025934E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3421 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3422 EBE=      -3.642635E+01 WEIGHT=    1.138730D+00 (bending)
3423 ESC=       5.606879E+01 WEIGHT=    1.625800D-01 (SC local)
3424 ETORS=     1.144374E+01 WEIGHT=    1.985990D+00 (torsional)
3425 ETORSD=   -1.792157E+00 WEIGHT=    1.570690D+00 (double torsional)
3426 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3427 ECORR4=   -7.031317E+01 WEIGHT=    4.288700D-01 (multi-body)
3428 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3429 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3430 EELLO=    -2.755653E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3431 ETURN3=    1.642101E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3432 ETURN4=   -3.240078E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3433 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3434 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3435 EDIHC=     0.000000E+00 (dihedral angle constraints)
3436 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3437 UCONST=     0.000000E+00 (Constraint energy)
3438 EDFAD=     5.491269-315 (DFA distance energy)
3439 EDFAT=     6.953158-310 (DFA torsion energy)
3440 EDFAN=     6.953158-310 (DFA NCa energy)
3441 EDFAB=     2.650815-317 (DFA Beta energy)
3442 ETOT=     -8.347934E+01 (total)
3443 RMS deviation from the reference structure:   3.861
3444  % of native contacts:  33.333
3445  % of nonnative contacts:  78.947
3446  contact order:   0.285
3447  TM-score with the reference structure:     0.27
3448  Conformation #          91  read
3449
3450
3451  Conformation #          90  sumsl return code            4
3452
3453 Virtual-chain energies:
3454
3455 EVDW=     -5.071208E+01 WEIGHT=    1.352790D+00 (SC-SC)
3456 EVDW2=     4.534097E+01 WEIGHT=    1.593040D+00 (SC-p)
3457 EES=      -8.866029E+01 WEIGHT=    7.153400D-01 (p-p)
3458 EVDWPP=   -1.940096E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3459 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3460 EBE=      -3.866068E+01 WEIGHT=    1.138730D+00 (bending)
3461 ESC=       4.522199E+01 WEIGHT=    1.625800D-01 (SC local)
3462 ETORS=     7.788583E+00 WEIGHT=    1.985990D+00 (torsional)
3463 ETORSD=   -2.193343E+00 WEIGHT=    1.570690D+00 (double torsional)
3464 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3465 ECORR4=   -6.683117E+01 WEIGHT=    4.288700D-01 (multi-body)
3466 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3467 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3468 EELLO=    -4.065909E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3469 ETURN3=    1.787543E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3470 ETURN4=   -1.817383E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3471 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3472 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3473 EDIHC=     0.000000E+00 (dihedral angle constraints)
3474 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3475 UCONST=     0.000000E+00 (Constraint energy)
3476 EDFAD=     5.491269-315 (DFA distance energy)
3477 EDFAT=     6.953158-310 (DFA torsion energy)
3478 EDFAN=     6.953158-310 (DFA NCa energy)
3479 EDFAB=     2.650815-317 (DFA Beta energy)
3480 ETOT=     -8.700782E+01 (total)
3481 RMS deviation from the reference structure:   6.747
3482  % of native contacts:  25.000
3483  % of nonnative contacts:  81.250
3484  contact order:   0.250
3485  TM-score with the reference structure:     0.29
3486  Conformation #          92  read
3487
3488
3489  Conformation #          91  sumsl return code            4
3490
3491 Virtual-chain energies:
3492
3493 EVDW=     -5.146604E+01 WEIGHT=    1.352790D+00 (SC-SC)
3494 EVDW2=     5.202908E+01 WEIGHT=    1.593040D+00 (SC-p)
3495 EES=      -9.715811E+01 WEIGHT=    7.153400D-01 (p-p)
3496 EVDWPP=   -3.629966E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3497 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3498 EBE=      -3.906362E+01 WEIGHT=    1.138730D+00 (bending)
3499 ESC=       3.600431E+01 WEIGHT=    1.625800D-01 (SC local)
3500 ETORS=     1.031970E+01 WEIGHT=    1.985990D+00 (torsional)
3501 ETORSD=   -2.479356E+00 WEIGHT=    1.570690D+00 (double torsional)
3502 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3503 ECORR4=   -7.306525E+01 WEIGHT=    4.288700D-01 (multi-body)
3504 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3505 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3506 EELLO=    -2.842392E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3507 ETURN3=    1.622524E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3508 ETURN4=    1.432079E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3509 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3510 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3511 EDIHC=     0.000000E+00 (dihedral angle constraints)
3512 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3513 UCONST=     0.000000E+00 (Constraint energy)
3514 EDFAD=     5.491269-315 (DFA distance energy)
3515 EDFAT=     6.953158-310 (DFA torsion energy)
3516 EDFAN=     6.953158-310 (DFA NCa energy)
3517 EDFAB=     2.650815-317 (DFA Beta energy)
3518 ETOT=     -8.586317E+01 (total)
3519 RMS deviation from the reference structure:   3.982
3520  % of native contacts:  16.667
3521  % of nonnative contacts:  88.889
3522  contact order:   0.270
3523  TM-score with the reference structure:     0.28
3524  Conformation #          93  read
3525
3526
3527  Conformation #          81  sumsl return code            4
3528
3529 Virtual-chain energies:
3530
3531 EVDW=     -5.208552E+01 WEIGHT=    1.352790D+00 (SC-SC)
3532 EVDW2=     5.149303E+01 WEIGHT=    1.593040D+00 (SC-p)
3533 EES=      -1.046039E+02 WEIGHT=    7.153400D-01 (p-p)
3534 EVDWPP=   -2.534714E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3535 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3536 EBE=      -3.622360E+01 WEIGHT=    1.138730D+00 (bending)
3537 ESC=       4.707095E+01 WEIGHT=    1.625800D-01 (SC local)
3538 ETORS=     9.153770E+00 WEIGHT=    1.985990D+00 (torsional)
3539 ETORSD=   -4.547313E-01 WEIGHT=    1.570690D+00 (double torsional)
3540 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3541 ECORR4=   -7.751411E+01 WEIGHT=    4.288700D-01 (multi-body)
3542 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3543 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3544 EELLO=    -6.090236E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3545 ETURN3=    1.859781E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3546 ETURN4=   -3.169534E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3547 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3548 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3549 EDIHC=     0.000000E+00 (dihedral angle constraints)
3550 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3551 UCONST=     0.000000E+00 (Constraint energy)
3552 EDFAD=     5.491269-315 (DFA distance energy)
3553 EDFAT=     6.953158-310 (DFA torsion energy)
3554 EDFAN=     6.953158-310 (DFA NCa energy)
3555 EDFAB=     2.650815-317 (DFA Beta energy)
3556 ETOT=     -8.721159E+01 (total)
3557 RMS deviation from the reference structure:   2.044
3558  % of native contacts:  66.667
3559  % of nonnative contacts:  57.895
3560  contact order:   0.289
3561  TM-score with the reference structure:     0.31
3562  Conformation #          94  read
3563
3564
3565  Conformation #          92  sumsl return code            4
3566
3567 Virtual-chain energies:
3568
3569 EVDW=     -5.303220E+01 WEIGHT=    1.352790D+00 (SC-SC)
3570 EVDW2=     4.180239E+01 WEIGHT=    1.593040D+00 (SC-p)
3571 EES=      -7.717061E+01 WEIGHT=    7.153400D-01 (p-p)
3572 EVDWPP=   -2.519101E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3573 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3574 EBE=      -3.811720E+01 WEIGHT=    1.138730D+00 (bending)
3575 ESC=       4.025393E+01 WEIGHT=    1.625800D-01 (SC local)
3576 ETORS=     8.394769E+00 WEIGHT=    1.985990D+00 (torsional)
3577 ETORSD=   -1.470874E+00 WEIGHT=    1.570690D+00 (double torsional)
3578 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3579 ECORR4=   -5.621015E+01 WEIGHT=    4.288700D-01 (multi-body)
3580 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3581 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3582 EELLO=     2.533027E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3583 ETURN3=    1.420583E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3584 ETURN4=   -3.014127E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3585 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3586 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3587 EDIHC=     0.000000E+00 (dihedral angle constraints)
3588 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3589 UCONST=     0.000000E+00 (Constraint energy)
3590 EDFAD=     5.491269-315 (DFA distance energy)
3591 EDFAT=     6.953158-310 (DFA torsion energy)
3592 EDFAN=     6.953158-310 (DFA NCa energy)
3593 EDFAB=     2.650815-317 (DFA Beta energy)
3594 ETOT=     -8.744387E+01 (total)
3595 RMS deviation from the reference structure:   4.453
3596  % of native contacts:  16.667
3597  % of nonnative contacts:  90.476
3598  contact order:   0.422
3599  TM-score with the reference structure:     0.30
3600  Conformation #          95  read
3601
3602
3603  Conformation #          93  sumsl return code            4
3604
3605 Virtual-chain energies:
3606
3607 EVDW=     -5.226614E+01 WEIGHT=    1.352790D+00 (SC-SC)
3608 EVDW2=     4.745809E+01 WEIGHT=    1.593040D+00 (SC-p)
3609 EES=      -9.028931E+01 WEIGHT=    7.153400D-01 (p-p)
3610 EVDWPP=   -2.597513E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3611 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3612 EBE=      -3.931165E+01 WEIGHT=    1.138730D+00 (bending)
3613 ESC=       4.317458E+01 WEIGHT=    1.625800D-01 (SC local)
3614 ETORS=     8.154076E+00 WEIGHT=    1.985990D+00 (torsional)
3615 ETORSD=   -1.785145E+00 WEIGHT=    1.570690D+00 (double torsional)
3616 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3617 ECORR4=   -6.515554E+01 WEIGHT=    4.288700D-01 (multi-body)
3618 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3619 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3620 EELLO=    -7.990279E-02 WEIGHT=    1.603600D-01 (electrostatic-local)
3621 ETURN3=    1.776963E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3622 ETURN4=    1.350796E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3623 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3624 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3625 EDIHC=     0.000000E+00 (dihedral angle constraints)
3626 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3627 UCONST=     0.000000E+00 (Constraint energy)
3628 EDFAD=     5.491269-315 (DFA distance energy)
3629 EDFAT=     6.953158-310 (DFA torsion energy)
3630 EDFAN=     6.953158-310 (DFA NCa energy)
3631 EDFAB=     2.650815-317 (DFA Beta energy)
3632 ETOT=     -8.407985E+01 (total)
3633 RMS deviation from the reference structure:   4.627
3634  % of native contacts:  41.667
3635  % of nonnative contacts:  75.000
3636  contact order:   0.366
3637  TM-score with the reference structure:     0.30
3638  Conformation #          96  read
3639
3640
3641  Conformation #          89  sumsl return code            4
3642
3643 Virtual-chain energies:
3644
3645 EVDW=     -5.216780E+01 WEIGHT=    1.352790D+00 (SC-SC)
3646 EVDW2=     4.605876E+01 WEIGHT=    1.593040D+00 (SC-p)
3647 EES=      -9.915539E+01 WEIGHT=    7.153400D-01 (p-p)
3648 EVDWPP=   -1.864593E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3649 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3650 EBE=      -3.764524E+01 WEIGHT=    1.138730D+00 (bending)
3651 ESC=       3.728191E+01 WEIGHT=    1.625800D-01 (SC local)
3652 ETORS=     9.457121E+00 WEIGHT=    1.985990D+00 (torsional)
3653 ETORSD=   -5.867677E-01 WEIGHT=    1.570690D+00 (double torsional)
3654 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3655 ECORR4=   -7.196797E+01 WEIGHT=    4.288700D-01 (multi-body)
3656 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3657 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3658 EELLO=    -3.961794E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3659 ETURN3=    2.051707E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3660 ETURN4=   -2.748902E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3661 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3662 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3663 EDIHC=     0.000000E+00 (dihedral angle constraints)
3664 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3665 UCONST=     0.000000E+00 (Constraint energy)
3666 EDFAD=     5.491269-315 (DFA distance energy)
3667 EDFAT=     6.953158-310 (DFA torsion energy)
3668 EDFAN=     6.953158-310 (DFA NCa energy)
3669 EDFAB=     2.650815-317 (DFA Beta energy)
3670 ETOT=     -8.789903E+01 (total)
3671 RMS deviation from the reference structure:   3.018
3672  % of native contacts:  33.333
3673  % of nonnative contacts:  80.000
3674  contact order:   0.311
3675  TM-score with the reference structure:     0.31
3676  Conformation #          97  read
3677
3678
3679  Conformation #          95  sumsl return code            4
3680
3681 Virtual-chain energies:
3682
3683 EVDW=     -5.158360E+01 WEIGHT=    1.352790D+00 (SC-SC)
3684 EVDW2=     3.240418E+01 WEIGHT=    1.593040D+00 (SC-p)
3685 EES=      -5.123465E+01 WEIGHT=    7.153400D-01 (p-p)
3686 EVDWPP=   -3.257724E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3687 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3688 EBE=      -3.959967E+01 WEIGHT=    1.138730D+00 (bending)
3689 ESC=       3.889849E+01 WEIGHT=    1.625800D-01 (SC local)
3690 ETORS=     5.591502E+00 WEIGHT=    1.985990D+00 (torsional)
3691 ETORSD=    2.569923E-01 WEIGHT=    1.570690D+00 (double torsional)
3692 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3693 ECORR4=   -3.446819E+01 WEIGHT=    4.288700D-01 (multi-body)
3694 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3695 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3696 EELLO=     1.747673E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
3697 ETURN3=    1.036650E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3698 ETURN4=   -3.305998E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3699 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3700 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3701 EDIHC=     0.000000E+00 (dihedral angle constraints)
3702 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3703 UCONST=     0.000000E+00 (Constraint energy)
3704 EDFAD=     5.491269-315 (DFA distance energy)
3705 EDFAT=     6.953158-310 (DFA torsion energy)
3706 EDFAN=     6.953158-310 (DFA NCa energy)
3707 EDFAB=     2.650815-317 (DFA Beta energy)
3708 ETOT=     -8.522942E+01 (total)
3709 RMS deviation from the reference structure:   6.253
3710  % of native contacts:  16.667
3711  % of nonnative contacts:  87.500
3712  contact order:   0.327
3713  TM-score with the reference structure:     0.23
3714  Conformation #          98  read
3715
3716
3717  Conformation #          97  sumsl return code            4
3718
3719 Virtual-chain energies:
3720
3721 EVDW=     -5.545589E+01 WEIGHT=    1.352790D+00 (SC-SC)
3722 EVDW2=     5.332955E+01 WEIGHT=    1.593040D+00 (SC-p)
3723 EES=      -9.803422E+01 WEIGHT=    7.153400D-01 (p-p)
3724 EVDWPP=   -3.502614E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3725 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3726 EBE=      -3.879955E+01 WEIGHT=    1.138730D+00 (bending)
3727 ESC=       5.383544E+01 WEIGHT=    1.625800D-01 (SC local)
3728 ETORS=     1.130221E+01 WEIGHT=    1.985990D+00 (torsional)
3729 ETORSD=   -3.385504E+00 WEIGHT=    1.570690D+00 (double torsional)
3730 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3731 ECORR4=   -7.478508E+01 WEIGHT=    4.288700D-01 (multi-body)
3732 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3733 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3734 EELLO=    -6.288442E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3735 ETURN3=    1.634837E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3736 ETURN4=    1.152505E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3737 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3738 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3739 EDIHC=     0.000000E+00 (dihedral angle constraints)
3740 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3741 UCONST=     0.000000E+00 (Constraint energy)
3742 EDFAD=     5.491269-315 (DFA distance energy)
3743 EDFAT=     6.953158-310 (DFA torsion energy)
3744 EDFAN=     6.953158-310 (DFA NCa energy)
3745 EDFAB=     2.650815-317 (DFA Beta energy)
3746 ETOT=     -8.721072E+01 (total)
3747 RMS deviation from the reference structure:   2.819
3748  % of native contacts:  58.333
3749  % of nonnative contacts:  72.000
3750  contact order:   0.373
3751  TM-score with the reference structure:     0.29
3752  Conformation #          99  read
3753
3754
3755  Conformation #          96  sumsl return code            4
3756
3757 Virtual-chain energies:
3758
3759 EVDW=     -5.326091E+01 WEIGHT=    1.352790D+00 (SC-SC)
3760 EVDW2=     4.708400E+01 WEIGHT=    1.593040D+00 (SC-p)
3761 EES=      -8.976567E+01 WEIGHT=    7.153400D-01 (p-p)
3762 EVDWPP=   -2.956288E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3763 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3764 EBE=      -3.744768E+01 WEIGHT=    1.138730D+00 (bending)
3765 ESC=       4.796956E+01 WEIGHT=    1.625800D-01 (SC local)
3766 ETORS=     7.044781E+00 WEIGHT=    1.985990D+00 (torsional)
3767 ETORSD=    3.133864E-01 WEIGHT=    1.570690D+00 (double torsional)
3768 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3769 ECORR4=   -6.799923E+01 WEIGHT=    4.288700D-01 (multi-body)
3770 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3771 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3772 EELLO=    -4.442120E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3773 ETURN3=    1.585610E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3774 ETURN4=   -1.833803E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3775 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3776 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3777 EDIHC=     0.000000E+00 (dihedral angle constraints)
3778 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3779 UCONST=     0.000000E+00 (Constraint energy)
3780 EDFAD=     5.491269-315 (DFA distance energy)
3781 EDFAT=     6.953158-310 (DFA torsion energy)
3782 EDFAN=     6.953158-310 (DFA NCa energy)
3783 EDFAB=     2.650815-317 (DFA Beta energy)
3784 ETOT=     -8.931648E+01 (total)
3785 RMS deviation from the reference structure:   3.239
3786  % of native contacts:  66.667
3787  % of nonnative contacts:  61.905
3788  contact order:   0.264
3789  TM-score with the reference structure:     0.31
3790  Conformation #         100  read
3791
3792
3793  Conformation #          94  sumsl return code            4
3794
3795 Virtual-chain energies:
3796
3797 EVDW=     -5.305504E+01 WEIGHT=    1.352790D+00 (SC-SC)
3798 EVDW2=     4.040257E+01 WEIGHT=    1.593040D+00 (SC-p)
3799 EES=      -7.338760E+01 WEIGHT=    7.153400D-01 (p-p)
3800 EVDWPP=   -2.906528E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3801 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3802 EBE=      -3.507829E+01 WEIGHT=    1.138730D+00 (bending)
3803 ESC=       3.942963E+01 WEIGHT=    1.625800D-01 (SC local)
3804 ETORS=     5.760565E+00 WEIGHT=    1.985990D+00 (torsional)
3805 ETORSD=   -7.554845E-01 WEIGHT=    1.570690D+00 (double torsional)
3806 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3807 ECORR4=   -5.481652E+01 WEIGHT=    4.288700D-01 (multi-body)
3808 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3809 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3810 EELLO=    -1.535032E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3811 ETURN3=    1.537199E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3812 ETURN4=   -6.138054E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
3813 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3814 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3815 EDIHC=     0.000000E+00 (dihedral angle constraints)
3816 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3817 UCONST=     0.000000E+00 (Constraint energy)
3818 EDFAD=     5.491269-315 (DFA distance energy)
3819 EDFAT=     6.953158-310 (DFA torsion energy)
3820 EDFAN=     6.953158-310 (DFA NCa energy)
3821 EDFAB=     2.650815-317 (DFA Beta energy)
3822 ETOT=     -8.471788E+01 (total)
3823 RMS deviation from the reference structure:   6.453
3824  % of native contacts:  33.333
3825  % of nonnative contacts:  80.000
3826  contact order:   0.259
3827  TM-score with the reference structure:     0.26
3828  Conformation #         101  read
3829
3830
3831  Conformation #         100  sumsl return code            4
3832
3833 Virtual-chain energies:
3834
3835 EVDW=     -5.724607E+01 WEIGHT=    1.352790D+00 (SC-SC)
3836 EVDW2=     5.144378E+01 WEIGHT=    1.593040D+00 (SC-p)
3837 EES=      -9.716260E+01 WEIGHT=    7.153400D-01 (p-p)
3838 EVDWPP=   -2.743794E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3839 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3840 EBE=      -3.757445E+01 WEIGHT=    1.138730D+00 (bending)
3841 ESC=       4.796478E+01 WEIGHT=    1.625800D-01 (SC local)
3842 ETORS=     1.260098E+01 WEIGHT=    1.985990D+00 (torsional)
3843 ETORSD=   -2.875661E+00 WEIGHT=    1.570690D+00 (double torsional)
3844 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3845 ECORR4=   -7.403382E+01 WEIGHT=    4.288700D-01 (multi-body)
3846 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3847 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3848 EELLO=    -7.543812E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3849 ETURN3=    1.718962E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3850 ETURN4=   -2.812276E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3851 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3852 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3853 EDIHC=     0.000000E+00 (dihedral angle constraints)
3854 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3855 UCONST=     0.000000E+00 (Constraint energy)
3856 EDFAD=     5.491269-315 (DFA distance energy)
3857 EDFAT=     6.953158-310 (DFA torsion energy)
3858 EDFAN=     6.953158-310 (DFA NCa energy)
3859 EDFAB=     2.650815-317 (DFA Beta energy)
3860 ETOT=     -8.841506E+01 (total)
3861 RMS deviation from the reference structure:   3.317
3862  % of native contacts:  33.333
3863  % of nonnative contacts:  78.947
3864  contact order:   0.354
3865  TM-score with the reference structure:     0.29
3866  Conformation #         102  read
3867
3868
3869  Conformation #         101  sumsl return code            4
3870
3871 Virtual-chain energies:
3872
3873 EVDW=     -5.535100E+01 WEIGHT=    1.352790D+00 (SC-SC)
3874 EVDW2=     4.839144E+01 WEIGHT=    1.593040D+00 (SC-p)
3875 EES=      -9.759179E+01 WEIGHT=    7.153400D-01 (p-p)
3876 EVDWPP=   -1.979413E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3877 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3878 EBE=      -3.837418E+01 WEIGHT=    1.138730D+00 (bending)
3879 ESC=       6.252031E+01 WEIGHT=    1.625800D-01 (SC local)
3880 ETORS=     8.699362E+00 WEIGHT=    1.985990D+00 (torsional)
3881 ETORSD=   -4.486982E-01 WEIGHT=    1.570690D+00 (double torsional)
3882 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3883 ECORR4=   -7.327375E+01 WEIGHT=    4.288700D-01 (multi-body)
3884 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3885 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3886 EELLO=    -3.023829E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3887 ETURN3=    1.939267E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3888 ETURN4=   -3.329018E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3889 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3890 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3891 EDIHC=     0.000000E+00 (dihedral angle constraints)
3892 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3893 UCONST=     0.000000E+00 (Constraint energy)
3894 EDFAD=     5.491269-315 (DFA distance energy)
3895 EDFAT=     6.953158-310 (DFA torsion energy)
3896 EDFAN=     6.953158-310 (DFA NCa energy)
3897 EDFAB=     2.650815-317 (DFA Beta energy)
3898 ETOT=     -8.820701E+01 (total)
3899 RMS deviation from the reference structure:   6.768
3900  % of native contacts:  33.333
3901  % of nonnative contacts:  78.947
3902  contact order:   0.239
3903  TM-score with the reference structure:     0.30
3904  Conformation #         103  read
3905
3906
3907  Conformation #          98  sumsl return code            4
3908
3909 Virtual-chain energies:
3910
3911 EVDW=     -5.023063E+01 WEIGHT=    1.352790D+00 (SC-SC)
3912 EVDW2=     4.036288E+01 WEIGHT=    1.593040D+00 (SC-p)
3913 EES=      -7.829780E+01 WEIGHT=    7.153400D-01 (p-p)
3914 EVDWPP=   -2.090614E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3915 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3916 EBE=      -3.855234E+01 WEIGHT=    1.138730D+00 (bending)
3917 ESC=       3.318744E+01 WEIGHT=    1.625800D-01 (SC local)
3918 ETORS=     9.763032E+00 WEIGHT=    1.985990D+00 (torsional)
3919 ETORSD=   -2.230908E+00 WEIGHT=    1.570690D+00 (double torsional)
3920 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3921 ECORR4=   -5.963788E+01 WEIGHT=    4.288700D-01 (multi-body)
3922 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3923 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3924 EELLO=     1.842996E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3925 ETURN3=    1.489684E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3926 ETURN4=   -2.092994E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3927 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3928 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3929 EDIHC=     0.000000E+00 (dihedral angle constraints)
3930 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3931 UCONST=     0.000000E+00 (Constraint energy)
3932 EDFAD=     5.491269-315 (DFA distance energy)
3933 EDFAT=     6.953158-310 (DFA torsion energy)
3934 EDFAN=     6.953158-310 (DFA NCa energy)
3935 EDFAB=     2.650815-317 (DFA Beta energy)
3936 ETOT=     -8.619176E+01 (total)
3937 RMS deviation from the reference structure:   4.544
3938  % of native contacts:  16.667
3939  % of nonnative contacts:  86.667
3940  contact order:   0.412
3941  TM-score with the reference structure:     0.31
3942  Conformation #         104  read
3943
3944
3945  Conformation #         102  sumsl return code            4
3946
3947 Virtual-chain energies:
3948
3949 EVDW=     -5.143525E+01 WEIGHT=    1.352790D+00 (SC-SC)
3950 EVDW2=     5.330895E+01 WEIGHT=    1.593040D+00 (SC-p)
3951 EES=      -1.094929E+02 WEIGHT=    7.153400D-01 (p-p)
3952 EVDWPP=   -2.933403E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3953 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3954 EBE=      -3.827661E+01 WEIGHT=    1.138730D+00 (bending)
3955 ESC=       4.515089E+01 WEIGHT=    1.625800D-01 (SC local)
3956 ETORS=     1.127806E+01 WEIGHT=    1.985990D+00 (torsional)
3957 ETORSD=   -8.212386E-01 WEIGHT=    1.570690D+00 (double torsional)
3958 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3959 ECORR4=   -8.108285E+01 WEIGHT=    4.288700D-01 (multi-body)
3960 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3961 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3962 EELLO=    -4.450661E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
3963 ETURN3=    1.904740E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
3964 ETURN4=   -2.458355E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
3965 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
3966 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
3967 EDIHC=     0.000000E+00 (dihedral angle constraints)
3968 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
3969 UCONST=     0.000000E+00 (Constraint energy)
3970 EDFAD=     5.491269-315 (DFA distance energy)
3971 EDFAT=     6.953158-310 (DFA torsion energy)
3972 EDFAN=     6.953158-310 (DFA NCa energy)
3973 EDFAB=     2.650815-317 (DFA Beta energy)
3974 ETOT=     -8.643466E+01 (total)
3975 RMS deviation from the reference structure:   2.882
3976  % of native contacts:  25.000
3977  % of nonnative contacts:  84.211
3978  contact order:   0.203
3979  TM-score with the reference structure:     0.27
3980  Conformation #         105  read
3981
3982
3983  Conformation #         104  sumsl return code            4
3984
3985 Virtual-chain energies:
3986
3987 EVDW=     -5.656538E+01 WEIGHT=    1.352790D+00 (SC-SC)
3988 EVDW2=     5.258591E+01 WEIGHT=    1.593040D+00 (SC-p)
3989 EES=      -1.034152E+02 WEIGHT=    7.153400D-01 (p-p)
3990 EVDWPP=   -2.375174E+01 WEIGHT=    1.137100D-01 (p-p VDW)
3991 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
3992 EBE=      -3.793318E+01 WEIGHT=    1.138730D+00 (bending)
3993 ESC=       4.643550E+01 WEIGHT=    1.625800D-01 (SC local)
3994 ETORS=     9.281829E+00 WEIGHT=    1.985990D+00 (torsional)
3995 ETORSD=   -1.594245E-01 WEIGHT=    1.570690D+00 (double torsional)
3996 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
3997 ECORR4=   -7.810727E+01 WEIGHT=    4.288700D-01 (multi-body)
3998 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
3999 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4000 EELLO=    -5.733387E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4001 ETURN3=    1.809409E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4002 ETURN4=   -2.663255E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4003 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4004 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4005 EDIHC=     0.000000E+00 (dihedral angle constraints)
4006 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4007 UCONST=     0.000000E+00 (Constraint energy)
4008 EDFAD=     5.491269-315 (DFA distance energy)
4009 EDFAT=     6.953158-310 (DFA torsion energy)
4010 EDFAN=     6.953158-310 (DFA NCa energy)
4011 EDFAB=     2.650815-317 (DFA Beta energy)
4012 ETOT=     -9.254286E+01 (total)
4013 RMS deviation from the reference structure:   2.382
4014  % of native contacts:  41.667
4015  % of nonnative contacts:  76.190
4016  contact order:   0.323
4017  TM-score with the reference structure:     0.29
4018  Conformation #         106  read
4019
4020
4021  Conformation #         105  sumsl return code            4
4022
4023 Virtual-chain energies:
4024
4025 EVDW=     -5.289427E+01 WEIGHT=    1.352790D+00 (SC-SC)
4026 EVDW2=     3.605960E+01 WEIGHT=    1.593040D+00 (SC-p)
4027 EES=      -6.295068E+01 WEIGHT=    7.153400D-01 (p-p)
4028 EVDWPP=   -2.980231E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4029 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4030 EBE=      -3.718328E+01 WEIGHT=    1.138730D+00 (bending)
4031 ESC=       4.526407E+01 WEIGHT=    1.625800D-01 (SC local)
4032 ETORS=     5.806244E+00 WEIGHT=    1.985990D+00 (torsional)
4033 ETORSD=   -1.783770E+00 WEIGHT=    1.570690D+00 (double torsional)
4034 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4035 ECORR4=   -4.623660E+01 WEIGHT=    4.288700D-01 (multi-body)
4036 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4037 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4038 EELLO=    -2.962557E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4039 ETURN3=    1.398270E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4040 ETURN4=   -1.266852E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4041 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4042 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4043 EDIHC=     0.000000E+00 (dihedral angle constraints)
4044 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4045 UCONST=     0.000000E+00 (Constraint energy)
4046 EDFAD=     5.491269-315 (DFA distance energy)
4047 EDFAT=     6.953158-310 (DFA torsion energy)
4048 EDFAN=     6.953158-310 (DFA NCa energy)
4049 EDFAB=     2.650815-317 (DFA Beta energy)
4050 ETOT=     -8.633541E+01 (total)
4051 RMS deviation from the reference structure:   4.495
4052  % of native contacts:  41.667
4053  % of nonnative contacts:  75.000
4054  contact order:   0.370
4055  TM-score with the reference structure:     0.28
4056  Conformation #         107  read
4057
4058
4059  Conformation #          74  sumsl return code            4
4060
4061 Virtual-chain energies:
4062
4063 EVDW=     -5.160989E+01 WEIGHT=    1.352790D+00 (SC-SC)
4064 EVDW2=     4.712138E+01 WEIGHT=    1.593040D+00 (SC-p)
4065 EES=      -9.602211E+01 WEIGHT=    7.153400D-01 (p-p)
4066 EVDWPP=   -2.953271E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4067 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4068 EBE=      -3.820742E+01 WEIGHT=    1.138730D+00 (bending)
4069 ESC=       4.485379E+01 WEIGHT=    1.625800D-01 (SC local)
4070 ETORS=     8.983691E+00 WEIGHT=    1.985990D+00 (torsional)
4071 ETORSD=    2.219656E+00 WEIGHT=    1.570690D+00 (double torsional)
4072 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4073 ECORR4=   -7.176673E+01 WEIGHT=    4.288700D-01 (multi-body)
4074 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4075 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4076 EELLO=    -5.653175E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4077 ETURN3=    1.842888E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4078 ETURN4=   -5.271701E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4079 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4080 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4081 EDIHC=     0.000000E+00 (dihedral angle constraints)
4082 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4083 UCONST=     0.000000E+00 (Constraint energy)
4084 EDFAD=     5.491269-315 (DFA distance energy)
4085 EDFAT=     6.953158-310 (DFA torsion energy)
4086 EDFAN=     6.953158-310 (DFA NCa energy)
4087 EDFAB=     2.650815-317 (DFA Beta energy)
4088 ETOT=     -8.576844E+01 (total)
4089 RMS deviation from the reference structure:   2.441
4090  % of native contacts:  41.667
4091  % of nonnative contacts:  76.190
4092  contact order:   0.353
4093  TM-score with the reference structure:     0.36
4094  Conformation #         108  read
4095
4096
4097  Conformation #         106  sumsl return code            4
4098
4099 Virtual-chain energies:
4100
4101 EVDW=     -5.302326E+01 WEIGHT=    1.352790D+00 (SC-SC)
4102 EVDW2=     4.551519E+01 WEIGHT=    1.593040D+00 (SC-p)
4103 EES=      -9.062950E+01 WEIGHT=    7.153400D-01 (p-p)
4104 EVDWPP=   -1.814223E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4105 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4106 EBE=      -3.701165E+01 WEIGHT=    1.138730D+00 (bending)
4107 ESC=       4.226743E+01 WEIGHT=    1.625800D-01 (SC local)
4108 ETORS=     9.326678E+00 WEIGHT=    1.985990D+00 (torsional)
4109 ETORSD=    5.504132E-01 WEIGHT=    1.570690D+00 (double torsional)
4110 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4111 ECORR4=   -6.826524E+01 WEIGHT=    4.288700D-01 (multi-body)
4112 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4113 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4114 EELLO=    -1.372321E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4115 ETURN3=    1.749307E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4116 ETURN4=   -2.991077E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4117 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4118 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4119 EDIHC=     0.000000E+00 (dihedral angle constraints)
4120 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4121 UCONST=     0.000000E+00 (Constraint energy)
4122 EDFAD=     5.491269-315 (DFA distance energy)
4123 EDFAT=     6.953158-310 (DFA torsion energy)
4124 EDFAN=     6.953158-310 (DFA NCa energy)
4125 EDFAB=     2.650815-317 (DFA Beta energy)
4126 ETOT=     -8.396620E+01 (total)
4127 RMS deviation from the reference structure:   5.572
4128  % of native contacts:  33.333
4129  % of nonnative contacts:  81.818
4130  contact order:   0.320
4131  TM-score with the reference structure:     0.32
4132  Conformation #         109  read
4133
4134
4135  Conformation #         107  sumsl return code            4
4136
4137 Virtual-chain energies:
4138
4139 EVDW=     -5.264810E+01 WEIGHT=    1.352790D+00 (SC-SC)
4140 EVDW2=     4.669071E+01 WEIGHT=    1.593040D+00 (SC-p)
4141 EES=      -9.895333E+01 WEIGHT=    7.153400D-01 (p-p)
4142 EVDWPP=   -1.958729E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4143 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4144 EBE=      -3.920952E+01 WEIGHT=    1.138730D+00 (bending)
4145 ESC=       3.800744E+01 WEIGHT=    1.625800D-01 (SC local)
4146 ETORS=     9.542073E+00 WEIGHT=    1.985990D+00 (torsional)
4147 ETORSD=   -6.834831E-01 WEIGHT=    1.570690D+00 (double torsional)
4148 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4149 ECORR4=   -7.181027E+01 WEIGHT=    4.288700D-01 (multi-body)
4150 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4151 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4152 EELLO=    -4.270745E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4153 ETURN3=    2.046080E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4154 ETURN4=   -2.835284E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4155 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4156 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4157 EDIHC=     0.000000E+00 (dihedral angle constraints)
4158 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4159 UCONST=     0.000000E+00 (Constraint energy)
4160 EDFAD=     5.491269-315 (DFA distance energy)
4161 EDFAT=     6.953158-310 (DFA torsion energy)
4162 EDFAN=     6.953158-310 (DFA NCa energy)
4163 EDFAB=     2.650815-317 (DFA Beta energy)
4164 ETOT=     -8.928515E+01 (total)
4165 RMS deviation from the reference structure:   3.100
4166  % of native contacts:  41.667
4167  % of nonnative contacts:  75.000
4168  contact order:   0.330
4169  TM-score with the reference structure:     0.31
4170  Conformation #         110  read
4171
4172
4173  Conformation #          76  sumsl return code            4
4174
4175 Virtual-chain energies:
4176
4177 EVDW=     -5.100546E+01 WEIGHT=    1.352790D+00 (SC-SC)
4178 EVDW2=     4.225860E+01 WEIGHT=    1.593040D+00 (SC-p)
4179 EES=      -8.688269E+01 WEIGHT=    7.153400D-01 (p-p)
4180 EVDWPP=   -1.518619E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4181 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4182 EBE=      -3.920444E+01 WEIGHT=    1.138730D+00 (bending)
4183 ESC=       4.608150E+01 WEIGHT=    1.625800D-01 (SC local)
4184 ETORS=     9.241781E+00 WEIGHT=    1.985990D+00 (torsional)
4185 ETORSD=   -1.790444E+00 WEIGHT=    1.570690D+00 (double torsional)
4186 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4187 ECORR4=   -6.548464E+01 WEIGHT=    4.288700D-01 (multi-body)
4188 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4189 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4190 EELLO=    -1.115284E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4191 ETURN3=    1.801226E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4192 ETURN4=   -3.038171E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4193 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4194 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4195 EDIHC=     0.000000E+00 (dihedral angle constraints)
4196 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4197 UCONST=     0.000000E+00 (Constraint energy)
4198 EDFAD=     5.491269-315 (DFA distance energy)
4199 EDFAT=     6.953158-310 (DFA torsion energy)
4200 EDFAN=     6.953158-310 (DFA NCa energy)
4201 EDFAB=     2.650815-317 (DFA Beta energy)
4202 ETOT=     -8.705180E+01 (total)
4203 RMS deviation from the reference structure:   5.173
4204  % of native contacts:  33.333
4205  % of nonnative contacts:  80.000
4206  contact order:   0.300
4207  TM-score with the reference structure:     0.31
4208  Conformation #         111  read
4209
4210
4211  Conformation #         109  sumsl return code            4
4212
4213 Virtual-chain energies:
4214
4215 EVDW=     -5.511754E+01 WEIGHT=    1.352790D+00 (SC-SC)
4216 EVDW2=     5.203137E+01 WEIGHT=    1.593040D+00 (SC-p)
4217 EES=      -1.003876E+02 WEIGHT=    7.153400D-01 (p-p)
4218 EVDWPP=   -2.872842E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4219 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4220 EBE=      -3.447944E+01 WEIGHT=    1.138730D+00 (bending)
4221 ESC=       5.851850E+01 WEIGHT=    1.625800D-01 (SC local)
4222 ETORS=     8.954505E+00 WEIGHT=    1.985990D+00 (torsional)
4223 ETORSD=    8.876741E-01 WEIGHT=    1.570690D+00 (double torsional)
4224 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4225 ECORR4=   -7.413289E+01 WEIGHT=    4.288700D-01 (multi-body)
4226 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4227 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4228 EELLO=    -5.851723E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4229 ETURN3=    1.654788E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4230 ETURN4=   -4.446977E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4231 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4232 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4233 EDIHC=     0.000000E+00 (dihedral angle constraints)
4234 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4235 UCONST=     0.000000E+00 (Constraint energy)
4236 EDFAD=     5.491269-315 (DFA distance energy)
4237 EDFAT=     6.953158-310 (DFA torsion energy)
4238 EDFAN=     6.953158-310 (DFA NCa energy)
4239 EDFAB=     2.650815-317 (DFA Beta energy)
4240 ETOT=     -8.508046E+01 (total)
4241 RMS deviation from the reference structure:   2.970
4242  % of native contacts:  58.333
4243  % of nonnative contacts:  73.077
4244  contact order:   0.329
4245  TM-score with the reference structure:     0.28
4246  Conformation #         112  read
4247
4248
4249  Conformation #         110  sumsl return code            4
4250
4251 Virtual-chain energies:
4252
4253 EVDW=     -5.235956E+01 WEIGHT=    1.352790D+00 (SC-SC)
4254 EVDW2=     4.791795E+01 WEIGHT=    1.593040D+00 (SC-p)
4255 EES=      -8.765061E+01 WEIGHT=    7.153400D-01 (p-p)
4256 EVDWPP=   -2.432428E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4257 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4258 EBE=      -3.926526E+01 WEIGHT=    1.138730D+00 (bending)
4259 ESC=       3.043079E+01 WEIGHT=    1.625800D-01 (SC local)
4260 ETORS=     8.901212E+00 WEIGHT=    1.985990D+00 (torsional)
4261 ETORSD=   -8.860118E-01 WEIGHT=    1.570690D+00 (double torsional)
4262 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4263 ECORR4=   -6.471032E+01 WEIGHT=    4.288700D-01 (multi-body)
4264 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4265 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4266 EELLO=     1.627734E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4267 ETURN3=    1.606694E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4268 ETURN4=   -1.519354E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4269 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4270 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4271 EDIHC=     0.000000E+00 (dihedral angle constraints)
4272 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4273 UCONST=     0.000000E+00 (Constraint energy)
4274 EDFAD=     5.491269-315 (DFA distance energy)
4275 EDFAT=     6.953158-310 (DFA torsion energy)
4276 EDFAN=     6.953158-310 (DFA NCa energy)
4277 EDFAB=     2.650815-317 (DFA Beta energy)
4278 ETOT=     -8.483028E+01 (total)
4279 RMS deviation from the reference structure:   4.780
4280  % of native contacts:  41.667
4281  % of nonnative contacts:  73.684
4282  contact order:   0.359
4283  TM-score with the reference structure:     0.29
4284  Conformation #         113  read
4285
4286
4287  Conformation #         103  sumsl return code            4
4288
4289 Virtual-chain energies:
4290
4291 EVDW=     -5.590397E+01 WEIGHT=    1.352790D+00 (SC-SC)
4292 EVDW2=     5.353249E+01 WEIGHT=    1.593040D+00 (SC-p)
4293 EES=      -1.085338E+02 WEIGHT=    7.153400D-01 (p-p)
4294 EVDWPP=   -2.416531E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4295 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4296 EBE=      -3.856788E+01 WEIGHT=    1.138730D+00 (bending)
4297 ESC=       5.894802E+01 WEIGHT=    1.625800D-01 (SC local)
4298 ETORS=     1.206290E+01 WEIGHT=    1.985990D+00 (torsional)
4299 ETORSD=   -2.159705E+00 WEIGHT=    1.570690D+00 (double torsional)
4300 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4301 ECORR4=   -8.397918E+01 WEIGHT=    4.288700D-01 (multi-body)
4302 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4303 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4304 EELLO=    -4.885036E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4305 ETURN3=    1.912651E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4306 ETURN4=    3.510779E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
4307 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4308 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4309 EDIHC=     0.000000E+00 (dihedral angle constraints)
4310 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4311 UCONST=     0.000000E+00 (Constraint energy)
4312 EDFAD=     5.491269-315 (DFA distance energy)
4313 EDFAT=     6.953158-310 (DFA torsion energy)
4314 EDFAN=     6.953158-310 (DFA NCa energy)
4315 EDFAB=     2.650815-317 (DFA Beta energy)
4316 ETOT=     -8.900905E+01 (total)
4317 RMS deviation from the reference structure:   2.513
4318  % of native contacts:  58.333
4319  % of nonnative contacts:  69.565
4320  contact order:   0.312
4321  TM-score with the reference structure:     0.33
4322  Conformation #         114  read
4323
4324
4325  Conformation #         113  sumsl return code            4
4326
4327 Virtual-chain energies:
4328
4329 EVDW=     -5.466127E+01 WEIGHT=    1.352790D+00 (SC-SC)
4330 EVDW2=     4.757760E+01 WEIGHT=    1.593040D+00 (SC-p)
4331 EES=      -9.467414E+01 WEIGHT=    7.153400D-01 (p-p)
4332 EVDWPP=   -2.411362E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4333 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4334 EBE=      -4.038540E+01 WEIGHT=    1.138730D+00 (bending)
4335 ESC=       5.535708E+01 WEIGHT=    1.625800D-01 (SC local)
4336 ETORS=     9.824628E+00 WEIGHT=    1.985990D+00 (torsional)
4337 ETORSD=    1.369934E+00 WEIGHT=    1.570690D+00 (double torsional)
4338 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4339 ECORR4=   -6.550612E+01 WEIGHT=    4.288700D-01 (multi-body)
4340 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4341 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4342 EELLO=     2.419460E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4343 ETURN3=    1.783336E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4344 ETURN4=   -5.375778E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4345 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4346 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4347 EDIHC=     0.000000E+00 (dihedral angle constraints)
4348 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4349 UCONST=     0.000000E+00 (Constraint energy)
4350 EDFAD=     5.491269-315 (DFA distance energy)
4351 EDFAT=     6.953158-310 (DFA torsion energy)
4352 EDFAN=     6.953158-310 (DFA NCa energy)
4353 EDFAB=     2.650815-317 (DFA Beta energy)
4354 ETOT=     -8.512033E+01 (total)
4355 RMS deviation from the reference structure:   4.896
4356  % of native contacts:  33.333
4357  % of nonnative contacts:  78.947
4358  contact order:   0.282
4359  TM-score with the reference structure:     0.27
4360  Conformation #         115  read
4361
4362
4363  Conformation #         112  sumsl return code            4
4364
4365 Virtual-chain energies:
4366
4367 EVDW=     -5.242327E+01 WEIGHT=    1.352790D+00 (SC-SC)
4368 EVDW2=     5.094404E+01 WEIGHT=    1.593040D+00 (SC-p)
4369 EES=      -1.039435E+02 WEIGHT=    7.153400D-01 (p-p)
4370 EVDWPP=   -1.910171E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4371 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4372 EBE=      -4.130438E+01 WEIGHT=    1.138730D+00 (bending)
4373 ESC=       3.997114E+01 WEIGHT=    1.625800D-01 (SC local)
4374 ETORS=     1.202100E+01 WEIGHT=    1.985990D+00 (torsional)
4375 ETORSD=   -5.630433E-01 WEIGHT=    1.570690D+00 (double torsional)
4376 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4377 ECORR4=   -7.322731E+01 WEIGHT=    4.288700D-01 (multi-body)
4378 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4379 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4380 EELLO=     6.838928E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
4381 ETURN3=    1.713124E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4382 ETURN4=   -6.964243E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
4383 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4384 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4385 EDIHC=     0.000000E+00 (dihedral angle constraints)
4386 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4387 UCONST=     0.000000E+00 (Constraint energy)
4388 EDFAD=     5.491269-315 (DFA distance energy)
4389 EDFAT=     6.953158-310 (DFA torsion energy)
4390 EDFAN=     6.953158-310 (DFA NCa energy)
4391 EDFAB=     2.650815-317 (DFA Beta energy)
4392 ETOT=     -8.668798E+01 (total)
4393 RMS deviation from the reference structure:   3.428
4394  % of native contacts:  50.000
4395  % of nonnative contacts:  72.727
4396  contact order:   0.401
4397  TM-score with the reference structure:     0.27
4398  Conformation #         116  read
4399
4400
4401  Conformation #         115  sumsl return code            4
4402
4403 Virtual-chain energies:
4404
4405 EVDW=     -4.851068E+01 WEIGHT=    1.352790D+00 (SC-SC)
4406 EVDW2=     4.559134E+01 WEIGHT=    1.593040D+00 (SC-p)
4407 EES=      -8.666728E+01 WEIGHT=    7.153400D-01 (p-p)
4408 EVDWPP=   -3.081903E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4409 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4410 EBE=      -4.144644E+01 WEIGHT=    1.138730D+00 (bending)
4411 ESC=       3.433608E+01 WEIGHT=    1.625800D-01 (SC local)
4412 ETORS=     8.961358E+00 WEIGHT=    1.985990D+00 (torsional)
4413 ETORSD=    4.923647E-01 WEIGHT=    1.570690D+00 (double torsional)
4414 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4415 ECORR4=   -6.015026E+01 WEIGHT=    4.288700D-01 (multi-body)
4416 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4417 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4418 EELLO=    -2.200885E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4419 ETURN3=    1.436547E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4420 ETURN4=   -2.211555E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4421 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4422 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4423 EDIHC=     0.000000E+00 (dihedral angle constraints)
4424 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4425 UCONST=     0.000000E+00 (Constraint energy)
4426 EDFAD=     5.491269-315 (DFA distance energy)
4427 EDFAT=     6.953158-310 (DFA torsion energy)
4428 EDFAN=     6.953158-310 (DFA NCa energy)
4429 EDFAB=     2.650815-317 (DFA Beta energy)
4430 ETOT=     -8.491695E+01 (total)
4431 RMS deviation from the reference structure:   4.101
4432  % of native contacts:  33.333
4433  % of nonnative contacts:  76.471
4434  contact order:   0.321
4435  TM-score with the reference structure:     0.31
4436  Conformation #         117  read
4437
4438
4439  Conformation #         116  sumsl return code            4
4440
4441 Virtual-chain energies:
4442
4443 EVDW=     -5.346322E+01 WEIGHT=    1.352790D+00 (SC-SC)
4444 EVDW2=     5.023763E+01 WEIGHT=    1.593040D+00 (SC-p)
4445 EES=      -9.998351E+01 WEIGHT=    7.153400D-01 (p-p)
4446 EVDWPP=   -2.376518E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4447 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4448 EBE=      -3.884941E+01 WEIGHT=    1.138730D+00 (bending)
4449 ESC=       4.421116E+01 WEIGHT=    1.625800D-01 (SC local)
4450 ETORS=     8.581505E+00 WEIGHT=    1.985990D+00 (torsional)
4451 ETORSD=    9.189142E-01 WEIGHT=    1.570690D+00 (double torsional)
4452 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4453 ECORR4=   -7.527252E+01 WEIGHT=    4.288700D-01 (multi-body)
4454 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4455 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4456 EELLO=    -3.767585E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4457 ETURN3=    1.842217E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4458 ETURN4=   -3.985457E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4459 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4460 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4461 EDIHC=     0.000000E+00 (dihedral angle constraints)
4462 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4463 UCONST=     0.000000E+00 (Constraint energy)
4464 EDFAD=     5.491269-315 (DFA distance energy)
4465 EDFAT=     6.953158-310 (DFA torsion energy)
4466 EDFAN=     6.953158-310 (DFA NCa energy)
4467 EDFAB=     2.650815-317 (DFA Beta energy)
4468 ETOT=     -8.952713E+01 (total)
4469 RMS deviation from the reference structure:   2.605
4470  % of native contacts:  50.000
4471  % of nonnative contacts:  71.429
4472  contact order:   0.290
4473  TM-score with the reference structure:     0.30
4474  Conformation #         118  read
4475
4476
4477  Conformation #         114  sumsl return code            4
4478
4479 Virtual-chain energies:
4480
4481 EVDW=     -5.268079E+01 WEIGHT=    1.352790D+00 (SC-SC)
4482 EVDW2=     4.741509E+01 WEIGHT=    1.593040D+00 (SC-p)
4483 EES=      -9.630309E+01 WEIGHT=    7.153400D-01 (p-p)
4484 EVDWPP=   -2.337914E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4485 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4486 EBE=      -3.721869E+01 WEIGHT=    1.138730D+00 (bending)
4487 ESC=       4.598975E+01 WEIGHT=    1.625800D-01 (SC local)
4488 ETORS=     1.157598E+01 WEIGHT=    1.985990D+00 (torsional)
4489 ETORSD=   -4.446267E-01 WEIGHT=    1.570690D+00 (double torsional)
4490 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4491 ECORR4=   -7.037918E+01 WEIGHT=    4.288700D-01 (multi-body)
4492 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4493 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4494 EELLO=    -1.677141E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4495 ETURN3=    1.721241E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4496 ETURN4=   -4.211287E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4497 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4498 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4499 EDIHC=     0.000000E+00 (dihedral angle constraints)
4500 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4501 UCONST=     0.000000E+00 (Constraint energy)
4502 EDFAD=     5.491269-315 (DFA distance energy)
4503 EDFAT=     6.953158-310 (DFA torsion energy)
4504 EDFAN=     6.953158-310 (DFA NCa energy)
4505 EDFAB=     2.650815-317 (DFA Beta energy)
4506 ETOT=     -8.409392E+01 (total)
4507 RMS deviation from the reference structure:   3.329
4508  % of native contacts:  16.667
4509  % of nonnative contacts:  85.714
4510  contact order:   0.312
4511  TM-score with the reference structure:     0.28
4512  Conformation #         119  read
4513
4514
4515  Conformation #         108  sumsl return code            4
4516
4517 Virtual-chain energies:
4518
4519 EVDW=     -4.860408E+01 WEIGHT=    1.352790D+00 (SC-SC)
4520 EVDW2=     6.122271E+01 WEIGHT=    1.593040D+00 (SC-p)
4521 EES=      -1.220830E+02 WEIGHT=    7.153400D-01 (p-p)
4522 EVDWPP=   -1.535458E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4523 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4524 EBE=      -3.524350E+01 WEIGHT=    1.138730D+00 (bending)
4525 ESC=       4.195598E+01 WEIGHT=    1.625800D-01 (SC local)
4526 ETORS=     1.190706E+01 WEIGHT=    1.985990D+00 (torsional)
4527 ETORSD=   -2.261634E+00 WEIGHT=    1.570690D+00 (double torsional)
4528 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4529 ECORR4=   -9.534241E+01 WEIGHT=    4.288700D-01 (multi-body)
4530 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4531 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4532 EELLO=    -8.280665E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4533 ETURN3=    1.781935E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4534 ETURN4=   -5.590914E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4535 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4536 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4537 EDIHC=     0.000000E+00 (dihedral angle constraints)
4538 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4539 UCONST=     0.000000E+00 (Constraint energy)
4540 EDFAD=     5.491269-315 (DFA distance energy)
4541 EDFAT=     6.953158-310 (DFA torsion energy)
4542 EDFAN=     6.953158-310 (DFA NCa energy)
4543 EDFAB=     2.650815-317 (DFA Beta energy)
4544 ETOT=     -8.636945E+01 (total)
4545 RMS deviation from the reference structure:   3.095
4546  % of native contacts:  58.333
4547  % of nonnative contacts:  65.000
4548  contact order:   0.261
4549  TM-score with the reference structure:     0.29
4550  Conformation #         120  read
4551
4552
4553  Conformation #         111  sumsl return code            4
4554
4555 Virtual-chain energies:
4556
4557 EVDW=     -5.378916E+01 WEIGHT=    1.352790D+00 (SC-SC)
4558 EVDW2=     5.375793E+01 WEIGHT=    1.593040D+00 (SC-p)
4559 EES=      -1.063399E+02 WEIGHT=    7.153400D-01 (p-p)
4560 EVDWPP=   -1.885744E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4561 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4562 EBE=      -4.094057E+01 WEIGHT=    1.138730D+00 (bending)
4563 ESC=       2.870332E+01 WEIGHT=    1.625800D-01 (SC local)
4564 ETORS=     1.416172E+01 WEIGHT=    1.985990D+00 (torsional)
4565 ETORSD=   -2.469450E+00 WEIGHT=    1.570690D+00 (double torsional)
4566 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4567 ECORR4=   -7.827931E+01 WEIGHT=    4.288700D-01 (multi-body)
4568 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4569 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4570 EELLO=    -3.511283E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
4571 ETURN3=    1.794873E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4572 ETURN4=    1.158831E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4573 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4574 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4575 EDIHC=     0.000000E+00 (dihedral angle constraints)
4576 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4577 UCONST=     0.000000E+00 (Constraint energy)
4578 EDFAD=     5.491269-315 (DFA distance energy)
4579 EDFAT=     6.953158-310 (DFA torsion energy)
4580 EDFAN=     6.953158-310 (DFA NCa energy)
4581 EDFAB=     2.650815-317 (DFA Beta energy)
4582 ETOT=     -8.562473E+01 (total)
4583 RMS deviation from the reference structure:   4.105
4584  % of native contacts:  41.667
4585  % of nonnative contacts:  75.000
4586  contact order:   0.300
4587  TM-score with the reference structure:     0.29
4588  Conformation #         121  read
4589
4590
4591  Conformation #         119  sumsl return code            4
4592
4593 Virtual-chain energies:
4594
4595 EVDW=     -5.331292E+01 WEIGHT=    1.352790D+00 (SC-SC)
4596 EVDW2=     5.197925E+01 WEIGHT=    1.593040D+00 (SC-p)
4597 EES=      -1.034186E+02 WEIGHT=    7.153400D-01 (p-p)
4598 EVDWPP=   -2.415704E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4599 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4600 EBE=      -3.593420E+01 WEIGHT=    1.138730D+00 (bending)
4601 ESC=       3.257270E+01 WEIGHT=    1.625800D-01 (SC local)
4602 ETORS=     9.460081E+00 WEIGHT=    1.985990D+00 (torsional)
4603 ETORSD=   -2.555473E-01 WEIGHT=    1.570690D+00 (double torsional)
4604 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4605 ECORR4=   -7.828414E+01 WEIGHT=    4.288700D-01 (multi-body)
4606 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4607 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4608 EELLO=    -5.731423E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4609 ETURN3=    1.829564E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4610 ETURN4=   -2.497192E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4611 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4612 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4613 EDIHC=     0.000000E+00 (dihedral angle constraints)
4614 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4615 UCONST=     0.000000E+00 (Constraint energy)
4616 EDFAD=     5.491269-315 (DFA distance energy)
4617 EDFAT=     6.953158-310 (DFA torsion energy)
4618 EDFAN=     6.953158-310 (DFA NCa energy)
4619 EDFAB=     2.650815-317 (DFA Beta energy)
4620 ETOT=     -8.855785E+01 (total)
4621 RMS deviation from the reference structure:   2.345
4622  % of native contacts:  50.000
4623  % of nonnative contacts:  72.727
4624  contact order:   0.339
4625  TM-score with the reference structure:     0.30
4626  Conformation #         122  read
4627
4628
4629  Conformation #         117  sumsl return code            4
4630
4631 Virtual-chain energies:
4632
4633 EVDW=     -5.380249E+01 WEIGHT=    1.352790D+00 (SC-SC)
4634 EVDW2=     4.929180E+01 WEIGHT=    1.593040D+00 (SC-p)
4635 EES=      -1.007539E+02 WEIGHT=    7.153400D-01 (p-p)
4636 EVDWPP=   -2.523339E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4637 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4638 EBE=      -3.888660E+01 WEIGHT=    1.138730D+00 (bending)
4639 ESC=       4.005106E+01 WEIGHT=    1.625800D-01 (SC local)
4640 ETORS=     9.586017E+00 WEIGHT=    1.985990D+00 (torsional)
4641 ETORSD=    1.418497E-01 WEIGHT=    1.570690D+00 (double torsional)
4642 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4643 ECORR4=   -7.570984E+01 WEIGHT=    4.288700D-01 (multi-body)
4644 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4645 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4646 EELLO=    -5.752869E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4647 ETURN3=    1.841239E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4648 ETURN4=   -2.063718E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4649 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4650 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4651 EDIHC=     0.000000E+00 (dihedral angle constraints)
4652 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4653 UCONST=     0.000000E+00 (Constraint energy)
4654 EDFAD=     5.491269-315 (DFA distance energy)
4655 EDFAT=     6.953158-310 (DFA torsion energy)
4656 EDFAN=     6.953158-310 (DFA NCa energy)
4657 EDFAB=     2.650815-317 (DFA Beta energy)
4658 ETOT=     -9.140482E+01 (total)
4659 RMS deviation from the reference structure:   2.858
4660  % of native contacts:  50.000
4661  % of nonnative contacts:  72.727
4662  contact order:   0.289
4663  TM-score with the reference structure:     0.31
4664  Conformation #         123  read
4665
4666
4667  Conformation #          69  sumsl return code            4
4668
4669 Virtual-chain energies:
4670
4671 EVDW=     -4.920319E+01 WEIGHT=    1.352790D+00 (SC-SC)
4672 EVDW2=     3.643192E+01 WEIGHT=    1.593040D+00 (SC-p)
4673 EES=      -6.548397E+01 WEIGHT=    7.153400D-01 (p-p)
4674 EVDWPP=   -2.941732E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4675 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4676 EBE=      -3.939065E+01 WEIGHT=    1.138730D+00 (bending)
4677 ESC=       3.485384E+01 WEIGHT=    1.625800D-01 (SC local)
4678 ETORS=     5.975187E+00 WEIGHT=    1.985990D+00 (torsional)
4679 ETORSD=   -2.133724E+00 WEIGHT=    1.570690D+00 (double torsional)
4680 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4681 ECORR4=   -4.566465E+01 WEIGHT=    4.288700D-01 (multi-body)
4682 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4683 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4684 EELLO=     1.733689E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4685 ETURN3=    1.409397E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4686 ETURN4=    1.713680E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4687 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4688 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4689 EDIHC=     0.000000E+00 (dihedral angle constraints)
4690 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4691 UCONST=     0.000000E+00 (Constraint energy)
4692 EDFAD=     5.491269-315 (DFA distance energy)
4693 EDFAT=     6.953158-310 (DFA torsion energy)
4694 EDFAN=     6.953158-310 (DFA NCa energy)
4695 EDFAB=     2.650815-317 (DFA Beta energy)
4696 ETOT=     -8.377753E+01 (total)
4697 RMS deviation from the reference structure:   4.423
4698  % of native contacts:  25.000
4699  % of nonnative contacts:  83.333
4700  contact order:   0.394
4701  TM-score with the reference structure:     0.26
4702  Conformation #         124  read
4703
4704
4705  Conformation #         123  sumsl return code            4
4706
4707 Virtual-chain energies:
4708
4709 EVDW=     -4.818313E+01 WEIGHT=    1.352790D+00 (SC-SC)
4710 EVDW2=     4.869203E+01 WEIGHT=    1.593040D+00 (SC-p)
4711 EES=      -9.087081E+01 WEIGHT=    7.153400D-01 (p-p)
4712 EVDWPP=   -3.098310E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4713 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4714 EBE=      -3.900805E+01 WEIGHT=    1.138730D+00 (bending)
4715 ESC=       2.979270E+01 WEIGHT=    1.625800D-01 (SC local)
4716 ETORS=     1.048510E+01 WEIGHT=    1.985990D+00 (torsional)
4717 ETORSD=   -2.670117E+00 WEIGHT=    1.570690D+00 (double torsional)
4718 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4719 ECORR4=   -6.762290E+01 WEIGHT=    4.288700D-01 (multi-body)
4720 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4721 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4722 EELLO=     1.112720E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4723 ETURN3=    1.350122E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4724 ETURN4=   -1.988614E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
4725 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4726 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4727 EDIHC=     0.000000E+00 (dihedral angle constraints)
4728 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4729 UCONST=     0.000000E+00 (Constraint energy)
4730 EDFAD=     5.491269-315 (DFA distance energy)
4731 EDFAT=     6.953158-310 (DFA torsion energy)
4732 EDFAN=     6.953158-310 (DFA NCa energy)
4733 EDFAB=     2.650815-317 (DFA Beta energy)
4734 ETOT=     -8.526164E+01 (total)
4735 RMS deviation from the reference structure:   4.105
4736  % of native contacts:  50.000
4737  % of nonnative contacts:  70.000
4738  contact order:   0.357
4739  TM-score with the reference structure:     0.31
4740  Conformation #         125  read
4741
4742
4743  Conformation #         122  sumsl return code            4
4744
4745 Virtual-chain energies:
4746
4747 EVDW=     -5.397051E+01 WEIGHT=    1.352790D+00 (SC-SC)
4748 EVDW2=     4.522837E+01 WEIGHT=    1.593040D+00 (SC-p)
4749 EES=      -8.637575E+01 WEIGHT=    7.153400D-01 (p-p)
4750 EVDWPP=   -3.004787E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4751 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4752 EBE=      -3.737668E+01 WEIGHT=    1.138730D+00 (bending)
4753 ESC=       4.173907E+01 WEIGHT=    1.625800D-01 (SC local)
4754 ETORS=     7.419752E+00 WEIGHT=    1.985990D+00 (torsional)
4755 ETORSD=    7.381487E-01 WEIGHT=    1.570690D+00 (double torsional)
4756 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4757 ECORR4=   -6.527592E+01 WEIGHT=    4.288700D-01 (multi-body)
4758 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4759 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4760 EELLO=    -4.332356E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4761 ETURN3=    1.653682E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4762 ETURN4=   -1.917438E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4763 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4764 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4765 EDIHC=     0.000000E+00 (dihedral angle constraints)
4766 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4767 UCONST=     0.000000E+00 (Constraint energy)
4768 EDFAD=     5.491269-315 (DFA distance energy)
4769 EDFAT=     6.953158-310 (DFA torsion energy)
4770 EDFAN=     6.953158-310 (DFA NCa energy)
4771 EDFAB=     2.650815-317 (DFA Beta energy)
4772 ETOT=     -8.810428E+01 (total)
4773 RMS deviation from the reference structure:   2.962
4774  % of native contacts:  50.000
4775  % of nonnative contacts:  72.727
4776  contact order:   0.312
4777  TM-score with the reference structure:     0.30
4778  Conformation #         126  read
4779
4780
4781  Conformation #         125  sumsl return code            4
4782
4783 Virtual-chain energies:
4784
4785 EVDW=     -5.078950E+01 WEIGHT=    1.352790D+00 (SC-SC)
4786 EVDW2=     4.913631E+01 WEIGHT=    1.593040D+00 (SC-p)
4787 EES=      -9.987614E+01 WEIGHT=    7.153400D-01 (p-p)
4788 EVDWPP=   -2.172987E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4789 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4790 EBE=      -4.042024E+01 WEIGHT=    1.138730D+00 (bending)
4791 ESC=       4.081295E+01 WEIGHT=    1.625800D-01 (SC local)
4792 ETORS=     1.022220E+01 WEIGHT=    1.985990D+00 (torsional)
4793 ETORSD=    6.869584E-02 WEIGHT=    1.570690D+00 (double torsional)
4794 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4795 ECORR4=   -7.216795E+01 WEIGHT=    4.288700D-01 (multi-body)
4796 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4797 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4798 EELLO=    -5.321539E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4799 ETURN3=    1.944246E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4800 ETURN4=   -2.186088E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4801 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4802 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4803 EDIHC=     0.000000E+00 (dihedral angle constraints)
4804 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4805 UCONST=     0.000000E+00 (Constraint energy)
4806 EDFAD=     5.491269-315 (DFA distance energy)
4807 EDFAT=     6.953158-310 (DFA torsion energy)
4808 EDFAN=     6.953158-310 (DFA NCa energy)
4809 EDFAB=     2.650815-317 (DFA Beta energy)
4810 ETOT=     -8.377916E+01 (total)
4811 RMS deviation from the reference structure:   4.191
4812  % of native contacts:  33.333
4813  % of nonnative contacts:  80.952
4814  contact order:   0.294
4815  TM-score with the reference structure:     0.36
4816  Conformation #         127  read
4817
4818
4819  Conformation #         120  sumsl return code            4
4820
4821 Virtual-chain energies:
4822
4823 EVDW=     -5.245943E+01 WEIGHT=    1.352790D+00 (SC-SC)
4824 EVDW2=     4.785583E+01 WEIGHT=    1.593040D+00 (SC-p)
4825 EES=      -9.565528E+01 WEIGHT=    7.153400D-01 (p-p)
4826 EVDWPP=   -1.726569E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4827 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4828 EBE=      -3.671199E+01 WEIGHT=    1.138730D+00 (bending)
4829 ESC=       4.105299E+01 WEIGHT=    1.625800D-01 (SC local)
4830 ETORS=     1.056150E+01 WEIGHT=    1.985990D+00 (torsional)
4831 ETORSD=   -1.657892E+00 WEIGHT=    1.570690D+00 (double torsional)
4832 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4833 ECORR4=   -6.968664E+01 WEIGHT=    4.288700D-01 (multi-body)
4834 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4835 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4836 EELLO=    -1.870011E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4837 ETURN3=    1.838360E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4838 ETURN4=   -3.709290E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4839 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4840 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4841 EDIHC=     0.000000E+00 (dihedral angle constraints)
4842 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4843 UCONST=     0.000000E+00 (Constraint energy)
4844 EDFAD=     5.491269-315 (DFA distance energy)
4845 EDFAT=     6.953158-310 (DFA torsion energy)
4846 EDFAN=     6.953158-310 (DFA NCa energy)
4847 EDFAB=     2.650815-317 (DFA Beta energy)
4848 ETOT=     -8.350519E+01 (total)
4849 RMS deviation from the reference structure:   4.702
4850  % of native contacts:  25.000
4851  % of nonnative contacts:  85.714
4852  contact order:   0.333
4853  TM-score with the reference structure:     0.31
4854  Conformation #         128  read
4855
4856
4857  Conformation #         127  sumsl return code            4
4858
4859 Virtual-chain energies:
4860
4861 EVDW=     -5.219792E+01 WEIGHT=    1.352790D+00 (SC-SC)
4862 EVDW2=     4.767414E+01 WEIGHT=    1.593040D+00 (SC-p)
4863 EES=      -8.382230E+01 WEIGHT=    7.153400D-01 (p-p)
4864 EVDWPP=   -4.109974E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4865 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4866 EBE=      -4.128860E+01 WEIGHT=    1.138730D+00 (bending)
4867 ESC=       3.503076E+01 WEIGHT=    1.625800D-01 (SC local)
4868 ETORS=     8.940973E+00 WEIGHT=    1.985990D+00 (torsional)
4869 ETORSD=    6.380910E-01 WEIGHT=    1.570690D+00 (double torsional)
4870 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4871 ECORR4=   -5.982760E+01 WEIGHT=    4.288700D-01 (multi-body)
4872 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4873 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4874 EELLO=    -5.301500E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4875 ETURN3=    1.491043E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4876 ETURN4=   -1.548721E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4877 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4878 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4879 EDIHC=     0.000000E+00 (dihedral angle constraints)
4880 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4881 UCONST=     0.000000E+00 (Constraint energy)
4882 EDFAD=     5.491269-315 (DFA distance energy)
4883 EDFAT=     6.953158-310 (DFA torsion energy)
4884 EDFAN=     6.953158-310 (DFA NCa energy)
4885 EDFAB=     2.650815-317 (DFA Beta energy)
4886 ETOT=     -8.424020E+01 (total)
4887 RMS deviation from the reference structure:   3.844
4888  % of native contacts:  41.667
4889  % of nonnative contacts:  76.190
4890  contact order:   0.335
4891  TM-score with the reference structure:     0.27
4892  Conformation #         129  read
4893
4894
4895  Conformation #         121  sumsl return code            4
4896
4897 Virtual-chain energies:
4898
4899 EVDW=     -5.255276E+01 WEIGHT=    1.352790D+00 (SC-SC)
4900 EVDW2=     4.319358E+01 WEIGHT=    1.593040D+00 (SC-p)
4901 EES=      -8.048973E+01 WEIGHT=    7.153400D-01 (p-p)
4902 EVDWPP=   -2.373419E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4903 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4904 EBE=      -3.757984E+01 WEIGHT=    1.138730D+00 (bending)
4905 ESC=       4.333407E+01 WEIGHT=    1.625800D-01 (SC local)
4906 ETORS=     8.312364E+00 WEIGHT=    1.985990D+00 (torsional)
4907 ETORSD=   -1.918612E+00 WEIGHT=    1.570690D+00 (double torsional)
4908 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4909 ECORR4=   -5.966874E+01 WEIGHT=    4.288700D-01 (multi-body)
4910 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4911 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4912 EELLO=    -8.470271E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
4913 ETURN3=    1.663548E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4914 ETURN4=   -3.139967E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4915 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4916 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4917 EDIHC=     0.000000E+00 (dihedral angle constraints)
4918 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4919 UCONST=     0.000000E+00 (Constraint energy)
4920 EDFAD=     5.491269-315 (DFA distance energy)
4921 EDFAT=     6.953158-310 (DFA torsion energy)
4922 EDFAN=     6.953158-310 (DFA NCa energy)
4923 EDFAB=     2.650815-317 (DFA Beta energy)
4924 ETOT=     -8.455124E+01 (total)
4925 RMS deviation from the reference structure:   5.585
4926  % of native contacts:  41.667
4927  % of nonnative contacts:  76.190
4928  contact order:   0.390
4929  TM-score with the reference structure:     0.31
4930  Conformation #         130  read
4931
4932
4933  Conformation #         124  sumsl return code            4
4934
4935 Virtual-chain energies:
4936
4937 EVDW=     -5.216570E+01 WEIGHT=    1.352790D+00 (SC-SC)
4938 EVDW2=     5.398055E+01 WEIGHT=    1.593040D+00 (SC-p)
4939 EES=      -1.099487E+02 WEIGHT=    7.153400D-01 (p-p)
4940 EVDWPP=   -3.059308E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4941 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4942 EBE=      -4.016517E+01 WEIGHT=    1.138730D+00 (bending)
4943 ESC=       4.743627E+01 WEIGHT=    1.625800D-01 (SC local)
4944 ETORS=     1.139440E+01 WEIGHT=    1.985990D+00 (torsional)
4945 ETORSD=   -1.010718E+00 WEIGHT=    1.570690D+00 (double torsional)
4946 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4947 ECORR4=   -8.096375E+01 WEIGHT=    4.288700D-01 (multi-body)
4948 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4949 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4950 EELLO=    -4.274612E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4951 ETURN3=    1.929906E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4952 ETURN4=   -2.804433E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4953 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4954 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4955 EDIHC=     0.000000E+00 (dihedral angle constraints)
4956 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4957 UCONST=     0.000000E+00 (Constraint energy)
4958 EDFAD=     5.491269-315 (DFA distance energy)
4959 EDFAT=     6.953158-310 (DFA torsion energy)
4960 EDFAN=     6.953158-310 (DFA NCa energy)
4961 EDFAB=     2.650815-317 (DFA Beta energy)
4962 ETOT=     -8.839296E+01 (total)
4963 RMS deviation from the reference structure:   2.961
4964  % of native contacts:  25.000
4965  % of nonnative contacts:  85.000
4966  contact order:   0.250
4967  TM-score with the reference structure:     0.28
4968  Conformation #         131  read
4969
4970
4971  Conformation #         126  sumsl return code            4
4972
4973 Virtual-chain energies:
4974
4975 EVDW=     -5.315049E+01 WEIGHT=    1.352790D+00 (SC-SC)
4976 EVDW2=     4.486980E+01 WEIGHT=    1.593040D+00 (SC-p)
4977 EES=      -8.414008E+01 WEIGHT=    7.153400D-01 (p-p)
4978 EVDWPP=   -2.009192E+01 WEIGHT=    1.137100D-01 (p-p VDW)
4979 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
4980 EBE=      -3.792281E+01 WEIGHT=    1.138730D+00 (bending)
4981 ESC=       4.398079E+01 WEIGHT=    1.625800D-01 (SC local)
4982 ETORS=     6.827375E+00 WEIGHT=    1.985990D+00 (torsional)
4983 ETORSD=    2.220531E+00 WEIGHT=    1.570690D+00 (double torsional)
4984 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
4985 ECORR4=   -6.174507E+01 WEIGHT=    4.288700D-01 (multi-body)
4986 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4987 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
4988 EELLO=    -3.626258E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
4989 ETURN3=    1.563617E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
4990 ETURN4=   -4.296002E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
4991 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
4992 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
4993 EDIHC=     0.000000E+00 (dihedral angle constraints)
4994 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
4995 UCONST=     0.000000E+00 (Constraint energy)
4996 EDFAD=     5.491269-315 (DFA distance energy)
4997 EDFAT=     6.953158-310 (DFA torsion energy)
4998 EDFAN=     6.953158-310 (DFA NCa energy)
4999 EDFAB=     2.650815-317 (DFA Beta energy)
5000 ETOT=     -8.540776E+01 (total)
5001 RMS deviation from the reference structure:   5.716
5002  % of native contacts:  33.333
5003  % of nonnative contacts:  80.000
5004  contact order:   0.361
5005  TM-score with the reference structure:     0.29
5006  Conformation #         132  read
5007
5008
5009  Conformation #         118  sumsl return code            4
5010
5011 Virtual-chain energies:
5012
5013 EVDW=     -5.474473E+01 WEIGHT=    1.352790D+00 (SC-SC)
5014 EVDW2=     4.750560E+01 WEIGHT=    1.593040D+00 (SC-p)
5015 EES=      -9.412480E+01 WEIGHT=    7.153400D-01 (p-p)
5016 EVDWPP=   -2.369423E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5017 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5018 EBE=      -3.653839E+01 WEIGHT=    1.138730D+00 (bending)
5019 ESC=       5.578797E+01 WEIGHT=    1.625800D-01 (SC local)
5020 ETORS=     8.368973E+00 WEIGHT=    1.985990D+00 (torsional)
5021 ETORSD=   -8.265766E-01 WEIGHT=    1.570690D+00 (double torsional)
5022 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5023 ECORR4=   -7.186114E+01 WEIGHT=    4.288700D-01 (multi-body)
5024 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5025 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5026 EELLO=    -4.812655E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5027 ETURN3=    1.914220E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5028 ETURN4=   -6.140353E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5029 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5030 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5031 EDIHC=     0.000000E+00 (dihedral angle constraints)
5032 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5033 UCONST=     0.000000E+00 (Constraint energy)
5034 EDFAD=     5.491269-315 (DFA distance energy)
5035 EDFAT=     6.953158-310 (DFA torsion energy)
5036 EDFAN=     6.953158-310 (DFA NCa energy)
5037 EDFAB=     2.650815-317 (DFA Beta energy)
5038 ETOT=     -8.532067E+01 (total)
5039 RMS deviation from the reference structure:   6.960
5040  % of native contacts:  33.333
5041  % of nonnative contacts:  78.947
5042  contact order:   0.242
5043  TM-score with the reference structure:     0.32
5044  Conformation #         133  read
5045
5046
5047  Conformation #         129  sumsl return code            4
5048
5049 Virtual-chain energies:
5050
5051 EVDW=     -4.992025E+01 WEIGHT=    1.352790D+00 (SC-SC)
5052 EVDW2=     5.429407E+01 WEIGHT=    1.593040D+00 (SC-p)
5053 EES=      -1.131370E+02 WEIGHT=    7.153400D-01 (p-p)
5054 EVDWPP=   -1.881771E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5055 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5056 EBE=      -4.192389E+01 WEIGHT=    1.138730D+00 (bending)
5057 ESC=       3.779735E+01 WEIGHT=    1.625800D-01 (SC local)
5058 ETORS=     1.133735E+01 WEIGHT=    1.985990D+00 (torsional)
5059 ETORSD=    1.500099E-01 WEIGHT=    1.570690D+00 (double torsional)
5060 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5061 ECORR4=   -8.164916E+01 WEIGHT=    4.288700D-01 (multi-body)
5062 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5063 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5064 EELLO=    -6.690150E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5065 ETURN3=    2.142928E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5066 ETURN4=   -3.161981E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5067 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5068 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5069 EDIHC=     0.000000E+00 (dihedral angle constraints)
5070 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5071 UCONST=     0.000000E+00 (Constraint energy)
5072 EDFAD=     5.491269-315 (DFA distance energy)
5073 EDFAT=     6.953158-310 (DFA torsion energy)
5074 EDFAN=     6.953158-310 (DFA NCa energy)
5075 EDFAB=     2.650815-317 (DFA Beta energy)
5076 ETOT=     -8.498153E+01 (total)
5077 RMS deviation from the reference structure:   4.133
5078  % of native contacts:  33.333
5079  % of nonnative contacts:  80.952
5080  contact order:   0.292
5081  TM-score with the reference structure:     0.33
5082  Conformation #         134  read
5083
5084
5085  Conformation #         133  sumsl return code            4
5086
5087 Virtual-chain energies:
5088
5089 EVDW=     -5.189506E+01 WEIGHT=    1.352790D+00 (SC-SC)
5090 EVDW2=     4.757256E+01 WEIGHT=    1.593040D+00 (SC-p)
5091 EES=      -9.838629E+01 WEIGHT=    7.153400D-01 (p-p)
5092 EVDWPP=   -1.633343E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5093 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5094 EBE=      -3.915135E+01 WEIGHT=    1.138730D+00 (bending)
5095 ESC=       5.536124E+01 WEIGHT=    1.625800D-01 (SC local)
5096 ETORS=     9.916706E+00 WEIGHT=    1.985990D+00 (torsional)
5097 ETORSD=   -2.210189E+00 WEIGHT=    1.570690D+00 (double torsional)
5098 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5099 ECORR4=   -7.380771E+01 WEIGHT=    4.288700D-01 (multi-body)
5100 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5101 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5102 EELLO=     1.990572E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5103 ETURN3=    1.962722E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5104 ETURN4=   -1.617477E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5105 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5106 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5107 EDIHC=     0.000000E+00 (dihedral angle constraints)
5108 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5109 UCONST=     0.000000E+00 (Constraint energy)
5110 EDFAD=     5.491269-315 (DFA distance energy)
5111 EDFAT=     6.953158-310 (DFA torsion energy)
5112 EDFAN=     6.953158-310 (DFA NCa energy)
5113 EDFAB=     2.650815-317 (DFA Beta energy)
5114 ETOT=     -8.434067E+01 (total)
5115 RMS deviation from the reference structure:   6.540
5116  % of native contacts:  33.333
5117  % of nonnative contacts:  76.471
5118  contact order:   0.230
5119  TM-score with the reference structure:     0.31
5120  Conformation #         135  read
5121
5122
5123  Conformation #         132  sumsl return code            4
5124
5125 Virtual-chain energies:
5126
5127 EVDW=     -5.235582E+01 WEIGHT=    1.352790D+00 (SC-SC)
5128 EVDW2=     5.207807E+01 WEIGHT=    1.593040D+00 (SC-p)
5129 EES=      -1.071050E+02 WEIGHT=    7.153400D-01 (p-p)
5130 EVDWPP=   -1.711575E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5131 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5132 EBE=      -3.941223E+01 WEIGHT=    1.138730D+00 (bending)
5133 ESC=       4.129151E+01 WEIGHT=    1.625800D-01 (SC local)
5134 ETORS=     1.124429E+01 WEIGHT=    1.985990D+00 (torsional)
5135 ETORSD=   -6.972108E-01 WEIGHT=    1.570690D+00 (double torsional)
5136 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5137 ECORR4=   -8.103880E+01 WEIGHT=    4.288700D-01 (multi-body)
5138 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5139 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5140 EELLO=    -6.315093E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5141 ETURN3=    2.005791E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5142 ETURN4=   -8.401971E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5143 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5144 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5145 EDIHC=     0.000000E+00 (dihedral angle constraints)
5146 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5147 UCONST=     0.000000E+00 (Constraint energy)
5148 EDFAD=     5.491269-315 (DFA distance energy)
5149 EDFAT=     6.953158-310 (DFA torsion energy)
5150 EDFAN=     6.953158-310 (DFA NCa energy)
5151 EDFAB=     2.650815-317 (DFA Beta energy)
5152 ETOT=     -8.583962E+01 (total)
5153 RMS deviation from the reference structure:   2.352
5154  % of native contacts:  66.667
5155  % of nonnative contacts:  61.905
5156  contact order:   0.281
5157  TM-score with the reference structure:     0.33
5158  Conformation #         136  read
5159
5160
5161  Conformation #         135  sumsl return code            4
5162
5163 Virtual-chain energies:
5164
5165 EVDW=     -5.430661E+01 WEIGHT=    1.352790D+00 (SC-SC)
5166 EVDW2=     4.524140E+01 WEIGHT=    1.593040D+00 (SC-p)
5167 EES=      -9.366272E+01 WEIGHT=    7.153400D-01 (p-p)
5168 EVDWPP=   -1.848621E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5169 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5170 EBE=      -3.707444E+01 WEIGHT=    1.138730D+00 (bending)
5171 ESC=       6.001340E+01 WEIGHT=    1.625800D-01 (SC local)
5172 ETORS=     8.757867E+00 WEIGHT=    1.985990D+00 (torsional)
5173 ETORSD=   -4.223775E-01 WEIGHT=    1.570690D+00 (double torsional)
5174 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5175 ECORR4=   -7.061694E+01 WEIGHT=    4.288700D-01 (multi-body)
5176 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5177 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5178 EELLO=    -3.157413E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5179 ETURN3=    1.909434E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5180 ETURN4=   -3.376204E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5181 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5182 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5183 EDIHC=     0.000000E+00 (dihedral angle constraints)
5184 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5185 UCONST=     0.000000E+00 (Constraint energy)
5186 EDFAD=     5.491269-315 (DFA distance energy)
5187 EDFAT=     6.953158-310 (DFA torsion energy)
5188 EDFAN=     6.953158-310 (DFA NCa energy)
5189 EDFAB=     2.650815-317 (DFA Beta energy)
5190 ETOT=     -8.703953E+01 (total)
5191 RMS deviation from the reference structure:   6.698
5192  % of native contacts:  33.333
5193  % of nonnative contacts:  78.947
5194  contact order:   0.232
5195  TM-score with the reference structure:     0.29
5196  Conformation #         137  read
5197
5198
5199  Conformation #         134  sumsl return code            4
5200
5201 Virtual-chain energies:
5202
5203 EVDW=     -5.756770E+01 WEIGHT=    1.352790D+00 (SC-SC)
5204 EVDW2=     4.536451E+01 WEIGHT=    1.593040D+00 (SC-p)
5205 EES=      -8.876924E+01 WEIGHT=    7.153400D-01 (p-p)
5206 EVDWPP=   -2.032483E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5207 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5208 EBE=      -3.564443E+01 WEIGHT=    1.138730D+00 (bending)
5209 ESC=       5.664901E+01 WEIGHT=    1.625800D-01 (SC local)
5210 ETORS=     8.344204E+00 WEIGHT=    1.985990D+00 (torsional)
5211 ETORSD=   -5.974403E-01 WEIGHT=    1.570690D+00 (double torsional)
5212 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5213 ECORR4=   -6.272067E+01 WEIGHT=    4.288700D-01 (multi-body)
5214 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5215 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5216 EELLO=    -3.448776E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5217 ETURN3=    1.772444E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5218 ETURN4=   -3.314844E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5219 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5220 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5221 EDIHC=     0.000000E+00 (dihedral angle constraints)
5222 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5223 UCONST=     0.000000E+00 (Constraint energy)
5224 EDFAD=     5.491269-315 (DFA distance energy)
5225 EDFAT=     6.953158-310 (DFA torsion energy)
5226 EDFAN=     6.953158-310 (DFA NCa energy)
5227 EDFAB=     2.650815-317 (DFA Beta energy)
5228 ETOT=     -8.641183E+01 (total)
5229 RMS deviation from the reference structure:   5.109
5230  % of native contacts:  33.333
5231  % of nonnative contacts:  78.947
5232  contact order:   0.273
5233  TM-score with the reference structure:     0.29
5234  Conformation #         138  read
5235
5236
5237  Conformation #          99  sumsl return code            4
5238
5239 Virtual-chain energies:
5240
5241 EVDW=     -5.312104E+01 WEIGHT=    1.352790D+00 (SC-SC)
5242 EVDW2=     4.928392E+01 WEIGHT=    1.593040D+00 (SC-p)
5243 EES=      -1.012125E+02 WEIGHT=    7.153400D-01 (p-p)
5244 EVDWPP=   -3.084398E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5245 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5246 EBE=      -3.965962E+01 WEIGHT=    1.138730D+00 (bending)
5247 ESC=       4.104372E+01 WEIGHT=    1.625800D-01 (SC local)
5248 ETORS=     1.034439E+01 WEIGHT=    1.985990D+00 (torsional)
5249 ETORSD=    8.635473E-02 WEIGHT=    1.570690D+00 (double torsional)
5250 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5251 ECORR4=   -7.545925E+01 WEIGHT=    4.288700D-01 (multi-body)
5252 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5253 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5254 EELLO=    -4.838521E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5255 ETURN3=    1.896499E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5256 ETURN4=   -1.141075E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5257 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5258 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5259 EDIHC=     0.000000E+00 (dihedral angle constraints)
5260 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5261 UCONST=     0.000000E+00 (Constraint energy)
5262 EDFAD=     5.491269-315 (DFA distance energy)
5263 EDFAT=     6.953158-310 (DFA torsion energy)
5264 EDFAN=     6.953158-310 (DFA NCa energy)
5265 EDFAB=     2.650815-317 (DFA Beta energy)
5266 ETOT=     -8.896393E+01 (total)
5267 RMS deviation from the reference structure:   2.928
5268  % of native contacts:  41.667
5269  % of nonnative contacts:  75.000
5270  contact order:   0.295
5271  TM-score with the reference structure:     0.30
5272  Conformation #         139  read
5273
5274
5275  Conformation #         137  sumsl return code            4
5276
5277 Virtual-chain energies:
5278
5279 EVDW=     -5.367333E+01 WEIGHT=    1.352790D+00 (SC-SC)
5280 EVDW2=     5.318729E+01 WEIGHT=    1.593040D+00 (SC-p)
5281 EES=      -1.058128E+02 WEIGHT=    7.153400D-01 (p-p)
5282 EVDWPP=   -2.406776E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5283 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5284 EBE=      -4.243945E+01 WEIGHT=    1.138730D+00 (bending)
5285 ESC=       3.746250E+01 WEIGHT=    1.625800D-01 (SC local)
5286 ETORS=     1.207440E+01 WEIGHT=    1.985990D+00 (torsional)
5287 ETORSD=   -4.580531E-01 WEIGHT=    1.570690D+00 (double torsional)
5288 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5289 ECORR4=   -7.450411E+01 WEIGHT=    4.288700D-01 (multi-body)
5290 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5291 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5292 EELLO=    -1.356009E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5293 ETURN3=    2.003308E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5294 ETURN4=   -2.817261E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5295 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5296 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5297 EDIHC=     0.000000E+00 (dihedral angle constraints)
5298 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5299 UCONST=     0.000000E+00 (Constraint energy)
5300 EDFAD=     5.491269-315 (DFA distance energy)
5301 EDFAT=     6.953158-310 (DFA torsion energy)
5302 EDFAN=     6.953158-310 (DFA NCa energy)
5303 EDFAB=     2.650815-317 (DFA Beta energy)
5304 ETOT=     -8.552006E+01 (total)
5305 RMS deviation from the reference structure:   4.658
5306  % of native contacts:  25.000
5307  % of nonnative contacts:  86.957
5308  contact order:   0.318
5309  TM-score with the reference structure:     0.28
5310  Conformation #         140  read
5311
5312
5313  Conformation #         138  sumsl return code            4
5314
5315 Virtual-chain energies:
5316
5317 EVDW=     -5.300626E+01 WEIGHT=    1.352790D+00 (SC-SC)
5318 EVDW2=     3.615496E+01 WEIGHT=    1.593040D+00 (SC-p)
5319 EES=      -6.090571E+01 WEIGHT=    7.153400D-01 (p-p)
5320 EVDWPP=   -2.887493E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5321 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5322 EBE=      -3.653725E+01 WEIGHT=    1.138730D+00 (bending)
5323 ESC=       4.899935E+01 WEIGHT=    1.625800D-01 (SC local)
5324 ETORS=     4.950980E+00 WEIGHT=    1.985990D+00 (torsional)
5325 ETORSD=    4.426142E-02 WEIGHT=    1.570690D+00 (double torsional)
5326 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5327 ECORR4=   -4.299856E+01 WEIGHT=    4.288700D-01 (multi-body)
5328 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5329 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5330 EELLO=    -3.560256E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5331 ETURN3=    1.260465E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5332 ETURN4=   -3.665086E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5333 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5334 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5335 EDIHC=     0.000000E+00 (dihedral angle constraints)
5336 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5337 UCONST=     0.000000E+00 (Constraint energy)
5338 EDFAD=     5.491269-315 (DFA distance energy)
5339 EDFAT=     6.953158-310 (DFA torsion energy)
5340 EDFAN=     6.953158-310 (DFA NCa energy)
5341 EDFAB=     2.650815-317 (DFA Beta energy)
5342 ETOT=     -8.435777E+01 (total)
5343 RMS deviation from the reference structure:   4.236
5344  % of native contacts:  50.000
5345  % of nonnative contacts:  68.421
5346  contact order:   0.400
5347  TM-score with the reference structure:     0.24
5348  Conformation #         141  read
5349
5350
5351  Conformation #         140  sumsl return code            4
5352
5353 Virtual-chain energies:
5354
5355 EVDW=     -5.645151E+01 WEIGHT=    1.352790D+00 (SC-SC)
5356 EVDW2=     6.044597E+01 WEIGHT=    1.593040D+00 (SC-p)
5357 EES=      -1.145364E+02 WEIGHT=    7.153400D-01 (p-p)
5358 EVDWPP=   -2.092793E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5359 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5360 EBE=      -4.030256E+01 WEIGHT=    1.138730D+00 (bending)
5361 ESC=       3.586689E+01 WEIGHT=    1.625800D-01 (SC local)
5362 ETORS=     1.183785E+01 WEIGHT=    1.985990D+00 (torsional)
5363 ETORSD=    2.569821E-01 WEIGHT=    1.570690D+00 (double torsional)
5364 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5365 ECORR4=   -8.174140E+01 WEIGHT=    4.288700D-01 (multi-body)
5366 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5367 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5368 EELLO=    -1.712792E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5369 ETURN3=    1.731778E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5370 ETURN4=   -6.682769E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
5371 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5372 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5373 EDIHC=     0.000000E+00 (dihedral angle constraints)
5374 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5375 UCONST=     0.000000E+00 (Constraint energy)
5376 EDFAD=     5.491269-315 (DFA distance energy)
5377 EDFAT=     6.953158-310 (DFA torsion energy)
5378 EDFAN=     6.953158-310 (DFA NCa energy)
5379 EDFAB=     2.650815-317 (DFA Beta energy)
5380 ETOT=     -8.669181E+01 (total)
5381 RMS deviation from the reference structure:   4.091
5382  % of native contacts:  33.333
5383  % of nonnative contacts:  85.185
5384  contact order:   0.357
5385  TM-score with the reference structure:     0.29
5386  Conformation #         142  read
5387
5388
5389  Conformation #         141  sumsl return code            4
5390
5391 Virtual-chain energies:
5392
5393 EVDW=     -5.034257E+01 WEIGHT=    1.352790D+00 (SC-SC)
5394 EVDW2=     5.442400E+01 WEIGHT=    1.593040D+00 (SC-p)
5395 EES=      -1.209596E+02 WEIGHT=    7.153400D-01 (p-p)
5396 EVDWPP=   -9.411377E+00 WEIGHT=    1.137100D-01 (p-p VDW)
5397 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5398 EBE=      -4.015021E+01 WEIGHT=    1.138730D+00 (bending)
5399 ESC=       3.578735E+01 WEIGHT=    1.625800D-01 (SC local)
5400 ETORS=     1.459115E+01 WEIGHT=    1.985990D+00 (torsional)
5401 ETORSD=   -1.096742E+00 WEIGHT=    1.570690D+00 (double torsional)
5402 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5403 ECORR4=   -9.000401E+01 WEIGHT=    4.288700D-01 (multi-body)
5404 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5405 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5406 EELLO=    -6.529157E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5407 ETURN3=    2.030217E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5408 ETURN4=    6.080775E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5409 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5410 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5411 EDIHC=     0.000000E+00 (dihedral angle constraints)
5412 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5413 UCONST=     0.000000E+00 (Constraint energy)
5414 EDFAD=     5.491269-315 (DFA distance energy)
5415 EDFAT=     6.953158-310 (DFA torsion energy)
5416 EDFAN=     6.953158-310 (DFA NCa energy)
5417 EDFAB=     2.650815-317 (DFA Beta energy)
5418 ETOT=     -8.569521E+01 (total)
5419 RMS deviation from the reference structure:   1.555
5420  % of native contacts:  66.667
5421  % of nonnative contacts:  60.000
5422  contact order:   0.264
5423  TM-score with the reference structure:     0.33
5424  Conformation #         143  read
5425
5426
5427  Conformation #         139  sumsl return code            4
5428
5429 Virtual-chain energies:
5430
5431 EVDW=     -5.244726E+01 WEIGHT=    1.352790D+00 (SC-SC)
5432 EVDW2=     5.734514E+01 WEIGHT=    1.593040D+00 (SC-p)
5433 EES=      -1.172652E+02 WEIGHT=    7.153400D-01 (p-p)
5434 EVDWPP=   -1.521856E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5435 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5436 EBE=      -4.199964E+01 WEIGHT=    1.138730D+00 (bending)
5437 ESC=       4.745964E+01 WEIGHT=    1.625800D-01 (SC local)
5438 ETORS=     1.357475E+01 WEIGHT=    1.985990D+00 (torsional)
5439 ETORSD=   -1.633357E+00 WEIGHT=    1.570690D+00 (double torsional)
5440 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5441 ECORR4=   -9.060960E+01 WEIGHT=    4.288700D-01 (multi-body)
5442 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5443 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5444 EELLO=    -1.337424E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5445 ETURN3=    1.868176E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5446 ETURN4=   -1.054629E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5447 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5448 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5449 EDIHC=     0.000000E+00 (dihedral angle constraints)
5450 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5451 UCONST=     0.000000E+00 (Constraint energy)
5452 EDFAD=     5.491269-315 (DFA distance energy)
5453 EDFAT=     6.953158-310 (DFA torsion energy)
5454 EDFAN=     6.953158-310 (DFA NCa energy)
5455 EDFAB=     2.650815-317 (DFA Beta energy)
5456 ETOT=     -8.835924E+01 (total)
5457 RMS deviation from the reference structure:   2.565
5458  % of native contacts:  50.000
5459  % of nonnative contacts:  64.706
5460  contact order:   0.316
5461  TM-score with the reference structure:     0.30
5462  Conformation #         144  read
5463
5464
5465  Conformation #         143  sumsl return code            4
5466
5467 Virtual-chain energies:
5468
5469 EVDW=     -5.168270E+01 WEIGHT=    1.352790D+00 (SC-SC)
5470 EVDW2=     4.466127E+01 WEIGHT=    1.593040D+00 (SC-p)
5471 EES=      -8.769092E+01 WEIGHT=    7.153400D-01 (p-p)
5472 EVDWPP=   -1.996815E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5473 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5474 EBE=      -3.757063E+01 WEIGHT=    1.138730D+00 (bending)
5475 ESC=       4.149268E+01 WEIGHT=    1.625800D-01 (SC local)
5476 ETORS=     8.785018E+00 WEIGHT=    1.985990D+00 (torsional)
5477 ETORSD=   -2.049599E+00 WEIGHT=    1.570690D+00 (double torsional)
5478 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5479 ECORR4=   -6.622474E+01 WEIGHT=    4.288700D-01 (multi-body)
5480 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5481 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5482 EELLO=    -1.140957E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5483 ETURN3=    1.805006E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5484 ETURN4=   -2.270515E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5485 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5486 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5487 EDIHC=     0.000000E+00 (dihedral angle constraints)
5488 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5489 UCONST=     0.000000E+00 (Constraint energy)
5490 EDFAD=     5.491269-315 (DFA distance energy)
5491 EDFAT=     6.953158-310 (DFA torsion energy)
5492 EDFAN=     6.953158-310 (DFA NCa energy)
5493 EDFAB=     2.650815-317 (DFA Beta energy)
5494 ETOT=     -8.521142E+01 (total)
5495 RMS deviation from the reference structure:   4.999
5496  % of native contacts:  41.667
5497  % of nonnative contacts:  75.000
5498  contact order:   0.332
5499  TM-score with the reference structure:     0.31
5500  Conformation #         145  read
5501
5502
5503  Conformation #         136  sumsl return code            4
5504
5505 Virtual-chain energies:
5506
5507 EVDW=     -5.137167E+01 WEIGHT=    1.352790D+00 (SC-SC)
5508 EVDW2=     3.826020E+01 WEIGHT=    1.593040D+00 (SC-p)
5509 EES=      -5.567136E+01 WEIGHT=    7.153400D-01 (p-p)
5510 EVDWPP=   -3.534443E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5511 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5512 EBE=      -3.385100E+01 WEIGHT=    1.138730D+00 (bending)
5513 ESC=       3.354404E+01 WEIGHT=    1.625800D-01 (SC local)
5514 ETORS=     2.827090E+00 WEIGHT=    1.985990D+00 (torsional)
5515 ETORSD=    4.226415E-01 WEIGHT=    1.570690D+00 (double torsional)
5516 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5517 ECORR4=   -3.948086E+01 WEIGHT=    4.288700D-01 (multi-body)
5518 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5519 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5520 EELLO=    -1.189720E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5521 ETURN3=    6.395225E+00 WEIGHT=    1.687220D+00 (turns, 3rd order)
5522 ETURN4=    1.666936E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5523 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5524 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5525 EDIHC=     0.000000E+00 (dihedral angle constraints)
5526 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5527 UCONST=     0.000000E+00 (Constraint energy)
5528 EDFAD=     5.491269-315 (DFA distance energy)
5529 EDFAT=     6.953158-310 (DFA torsion energy)
5530 EDFAN=     6.953158-310 (DFA NCa energy)
5531 EDFAB=     2.650815-317 (DFA Beta energy)
5532 ETOT=     -8.443194E+01 (total)
5533 RMS deviation from the reference structure:   4.404
5534  % of native contacts:  25.000
5535  % of nonnative contacts:  83.333
5536  contact order:   0.432
5537  TM-score with the reference structure:     0.16
5538  Conformation #         146  read
5539
5540
5541  Conformation #         145  sumsl return code            4
5542
5543 Virtual-chain energies:
5544
5545 EVDW=     -5.575753E+01 WEIGHT=    1.352790D+00 (SC-SC)
5546 EVDW2=     5.509284E+01 WEIGHT=    1.593040D+00 (SC-p)
5547 EES=      -1.110953E+02 WEIGHT=    7.153400D-01 (p-p)
5548 EVDWPP=   -2.497661E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5549 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5550 EBE=      -3.835896E+01 WEIGHT=    1.138730D+00 (bending)
5551 ESC=       4.966412E+01 WEIGHT=    1.625800D-01 (SC local)
5552 ETORS=     1.307339E+01 WEIGHT=    1.985990D+00 (torsional)
5553 ETORSD=   -1.560249E+00 WEIGHT=    1.570690D+00 (double torsional)
5554 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5555 ECORR4=   -8.435212E+01 WEIGHT=    4.288700D-01 (multi-body)
5556 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5557 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5558 EELLO=    -2.372683E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5559 ETURN3=    1.993729E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5560 ETURN4=   -5.666365E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5561 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5562 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5563 EDIHC=     0.000000E+00 (dihedral angle constraints)
5564 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5565 UCONST=     0.000000E+00 (Constraint energy)
5566 EDFAD=     5.491269-315 (DFA distance energy)
5567 EDFAT=     6.953158-310 (DFA torsion energy)
5568 EDFAN=     6.953158-310 (DFA NCa energy)
5569 EDFAB=     2.650815-317 (DFA Beta energy)
5570 ETOT=     -8.536057E+01 (total)
5571 RMS deviation from the reference structure:   2.696
5572  % of native contacts:  50.000
5573  % of nonnative contacts:  68.421
5574  contact order:   0.342
5575  TM-score with the reference structure:     0.30
5576  Conformation #         147  read
5577
5578
5579  Conformation #         128  sumsl return code            4
5580
5581 Virtual-chain energies:
5582
5583 EVDW=     -5.109691E+01 WEIGHT=    1.352790D+00 (SC-SC)
5584 EVDW2=     4.613013E+01 WEIGHT=    1.593040D+00 (SC-p)
5585 EES=      -9.116374E+01 WEIGHT=    7.153400D-01 (p-p)
5586 EVDWPP=   -2.004559E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5587 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5588 EBE=      -3.783304E+01 WEIGHT=    1.138730D+00 (bending)
5589 ESC=       3.334579E+01 WEIGHT=    1.625800D-01 (SC local)
5590 ETORS=     8.889354E+00 WEIGHT=    1.985990D+00 (torsional)
5591 ETORSD=   -1.267366E+00 WEIGHT=    1.570690D+00 (double torsional)
5592 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5593 ECORR4=   -6.914368E+01 WEIGHT=    4.288700D-01 (multi-body)
5594 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5595 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5596 EELLO=    -3.942563E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5597 ETURN3=    1.833681E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5598 ETURN4=   -2.484581E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5599 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5600 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5601 EDIHC=     0.000000E+00 (dihedral angle constraints)
5602 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5603 UCONST=     0.000000E+00 (Constraint energy)
5604 EDFAD=     5.491269-315 (DFA distance energy)
5605 EDFAT=     6.953158-310 (DFA torsion energy)
5606 EDFAN=     6.953158-310 (DFA NCa energy)
5607 EDFAB=     2.650815-317 (DFA Beta energy)
5608 ETOT=     -8.611861E+01 (total)
5609 RMS deviation from the reference structure:   6.515
5610  % of native contacts:  16.667
5611  % of nonnative contacts:  88.889
5612  contact order:   0.240
5613  TM-score with the reference structure:     0.29
5614  Conformation #         148  read
5615
5616
5617  Conformation #         142  sumsl return code            4
5618
5619 Virtual-chain energies:
5620
5621 EVDW=     -4.896946E+01 WEIGHT=    1.352790D+00 (SC-SC)
5622 EVDW2=     3.899465E+01 WEIGHT=    1.593040D+00 (SC-p)
5623 EES=      -7.383812E+01 WEIGHT=    7.153400D-01 (p-p)
5624 EVDWPP=   -2.362475E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5625 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5626 EBE=      -3.763401E+01 WEIGHT=    1.138730D+00 (bending)
5627 ESC=       2.108967E+01 WEIGHT=    1.625800D-01 (SC local)
5628 ETORS=     7.452641E+00 WEIGHT=    1.985990D+00 (torsional)
5629 ETORSD=   -2.118518E+00 WEIGHT=    1.570690D+00 (double torsional)
5630 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5631 ECORR4=   -5.526611E+01 WEIGHT=    4.288700D-01 (multi-body)
5632 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5633 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5634 EELLO=    -8.800915E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5635 ETURN3=    1.597271E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5636 ETURN4=    6.868818E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
5637 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5638 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5639 EDIHC=     0.000000E+00 (dihedral angle constraints)
5640 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5641 UCONST=     0.000000E+00 (Constraint energy)
5642 EDFAD=     5.491269-315 (DFA distance energy)
5643 EDFAT=     6.953158-310 (DFA torsion energy)
5644 EDFAN=     6.953158-310 (DFA NCa energy)
5645 EDFAB=     2.650815-317 (DFA Beta energy)
5646 ETOT=     -8.402268E+01 (total)
5647 RMS deviation from the reference structure:   4.847
5648  % of native contacts:  25.000
5649  % of nonnative contacts:  82.353
5650  contact order:   0.393
5651  TM-score with the reference structure:     0.28
5652  Conformation #         149  read
5653
5654
5655  Conformation #         144  sumsl return code            4
5656
5657 Virtual-chain energies:
5658
5659 EVDW=     -5.547446E+01 WEIGHT=    1.352790D+00 (SC-SC)
5660 EVDW2=     5.257319E+01 WEIGHT=    1.593040D+00 (SC-p)
5661 EES=      -1.074350E+02 WEIGHT=    7.153400D-01 (p-p)
5662 EVDWPP=   -2.074813E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5663 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5664 EBE=      -3.852376E+01 WEIGHT=    1.138730D+00 (bending)
5665 ESC=       3.706158E+01 WEIGHT=    1.625800D-01 (SC local)
5666 ETORS=     1.247413E+01 WEIGHT=    1.985990D+00 (torsional)
5667 ETORSD=   -1.452256E+00 WEIGHT=    1.570690D+00 (double torsional)
5668 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5669 ECORR4=   -8.046857E+01 WEIGHT=    4.288700D-01 (multi-body)
5670 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5671 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5672 EELLO=    -2.466811E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5673 ETURN3=    2.058328E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5674 ETURN4=    8.747288E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
5675 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5676 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5677 EDIHC=     0.000000E+00 (dihedral angle constraints)
5678 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5679 UCONST=     0.000000E+00 (Constraint energy)
5680 EDFAD=     5.491269-315 (DFA distance energy)
5681 EDFAT=     6.953158-310 (DFA torsion energy)
5682 EDFAN=     6.953158-310 (DFA NCa energy)
5683 EDFAB=     2.650815-317 (DFA Beta energy)
5684 ETOT=     -8.597580E+01 (total)
5685 RMS deviation from the reference structure:   2.113
5686  % of native contacts:  58.333
5687  % of nonnative contacts:  69.565
5688  contact order:   0.354
5689  TM-score with the reference structure:     0.30
5690  Conformation #         150  read
5691
5692
5693  Conformation #         147  sumsl return code            4
5694
5695 Virtual-chain energies:
5696
5697 EVDW=     -5.155681E+01 WEIGHT=    1.352790D+00 (SC-SC)
5698 EVDW2=     4.818943E+01 WEIGHT=    1.593040D+00 (SC-p)
5699 EES=      -8.335082E+01 WEIGHT=    7.153400D-01 (p-p)
5700 EVDWPP=   -3.925071E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5701 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5702 EBE=      -3.648071E+01 WEIGHT=    1.138730D+00 (bending)
5703 ESC=       2.712920E+01 WEIGHT=    1.625800D-01 (SC local)
5704 ETORS=     7.176380E+00 WEIGHT=    1.985990D+00 (torsional)
5705 ETORSD=   -1.154835E-02 WEIGHT=    1.570690D+00 (double torsional)
5706 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5707 ECORR4=   -6.235225E+01 WEIGHT=    4.288700D-01 (multi-body)
5708 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5709 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5710 EELLO=    -5.790653E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5711 ETURN3=    1.316114E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5712 ETURN4=   -1.944163E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5713 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5714 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5715 EDIHC=     0.000000E+00 (dihedral angle constraints)
5716 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5717 UCONST=     0.000000E+00 (Constraint energy)
5718 EDFAD=     5.491269-315 (DFA distance energy)
5719 EDFAT=     6.953158-310 (DFA torsion energy)
5720 EDFAN=     6.953158-310 (DFA NCa energy)
5721 EDFAB=     2.650815-317 (DFA Beta energy)
5722 ETOT=     -8.671363E+01 (total)
5723 RMS deviation from the reference structure:   3.593
5724  % of native contacts:  41.667
5725  % of nonnative contacts:  76.190
5726  contact order:   0.381
5727  TM-score with the reference structure:     0.27
5728  Conformation #         151  read
5729
5730
5731  Conformation #         150  sumsl return code            4
5732
5733 Virtual-chain energies:
5734
5735 EVDW=     -5.396932E+01 WEIGHT=    1.352790D+00 (SC-SC)
5736 EVDW2=     4.430282E+01 WEIGHT=    1.593040D+00 (SC-p)
5737 EES=      -8.179717E+01 WEIGHT=    7.153400D-01 (p-p)
5738 EVDWPP=   -3.128901E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5739 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5740 EBE=      -3.421364E+01 WEIGHT=    1.138730D+00 (bending)
5741 ESC=       4.086732E+01 WEIGHT=    1.625800D-01 (SC local)
5742 ETORS=     6.028775E+00 WEIGHT=    1.985990D+00 (torsional)
5743 ETORSD=    2.895443E-01 WEIGHT=    1.570690D+00 (double torsional)
5744 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5745 ECORR4=   -6.095709E+01 WEIGHT=    4.288700D-01 (multi-body)
5746 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5747 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5748 EELLO=    -2.618412E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5749 ETURN3=    1.479271E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5750 ETURN4=   -5.319512E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
5751 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5752 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5753 EDIHC=     0.000000E+00 (dihedral angle constraints)
5754 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5755 UCONST=     0.000000E+00 (Constraint energy)
5756 EDFAD=     5.491269-315 (DFA distance energy)
5757 EDFAT=     6.953158-310 (DFA torsion energy)
5758 EDFAN=     6.953158-310 (DFA NCa energy)
5759 EDFAB=     2.650815-317 (DFA Beta energy)
5760 ETOT=     -8.603090E+01 (total)
5761 RMS deviation from the reference structure:   3.301
5762  % of native contacts:  66.667
5763  % of nonnative contacts:  60.000
5764  contact order:   0.295
5765  TM-score with the reference structure:     0.30
5766  Conformation #         152  read
5767
5768
5769  Conformation #         146  sumsl return code            4
5770
5771 Virtual-chain energies:
5772
5773 EVDW=     -4.706777E+01 WEIGHT=    1.352790D+00 (SC-SC)
5774 EVDW2=     4.079806E+01 WEIGHT=    1.593040D+00 (SC-p)
5775 EES=      -7.896290E+01 WEIGHT=    7.153400D-01 (p-p)
5776 EVDWPP=   -1.797634E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5777 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5778 EBE=      -4.035758E+01 WEIGHT=    1.138730D+00 (bending)
5779 ESC=       2.621479E+01 WEIGHT=    1.625800D-01 (SC local)
5780 ETORS=     7.445716E+00 WEIGHT=    1.985990D+00 (torsional)
5781 ETORSD=    7.402192E-01 WEIGHT=    1.570690D+00 (double torsional)
5782 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5783 ECORR4=   -5.810581E+01 WEIGHT=    4.288700D-01 (multi-body)
5784 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5785 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5786 EELLO=    -1.798879E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5787 ETURN3=    1.595769E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5788 ETURN4=   -4.682979E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5789 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5790 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5791 EDIHC=     0.000000E+00 (dihedral angle constraints)
5792 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5793 UCONST=     0.000000E+00 (Constraint energy)
5794 EDFAD=     5.491269-315 (DFA distance energy)
5795 EDFAT=     6.953158-310 (DFA torsion energy)
5796 EDFAN=     6.953158-310 (DFA NCa energy)
5797 EDFAB=     2.650815-317 (DFA Beta energy)
5798 ETOT=     -8.433961E+01 (total)
5799 RMS deviation from the reference structure:   4.735
5800  % of native contacts:  25.000
5801  % of nonnative contacts:  84.211
5802  contact order:   0.404
5803  TM-score with the reference structure:     0.30
5804  Conformation #         153  read
5805
5806
5807  Conformation #         152  sumsl return code            4
5808
5809 Virtual-chain energies:
5810
5811 EVDW=     -5.315680E+01 WEIGHT=    1.352790D+00 (SC-SC)
5812 EVDW2=     4.772072E+01 WEIGHT=    1.593040D+00 (SC-p)
5813 EES=      -8.983751E+01 WEIGHT=    7.153400D-01 (p-p)
5814 EVDWPP=   -3.007430E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5815 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5816 EBE=      -3.848395E+01 WEIGHT=    1.138730D+00 (bending)
5817 ESC=       4.971080E+01 WEIGHT=    1.625800D-01 (SC local)
5818 ETORS=     7.032006E+00 WEIGHT=    1.985990D+00 (torsional)
5819 ETORSD=    2.546598E-01 WEIGHT=    1.570690D+00 (double torsional)
5820 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5821 ECORR4=   -6.816331E+01 WEIGHT=    4.288700D-01 (multi-body)
5822 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5823 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5824 EELLO=    -4.178495E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5825 ETURN3=    1.548426E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5826 ETURN4=   -1.915466E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5827 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5828 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5829 EDIHC=     0.000000E+00 (dihedral angle constraints)
5830 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5831 UCONST=     0.000000E+00 (Constraint energy)
5832 EDFAD=     5.491269-315 (DFA distance energy)
5833 EDFAT=     6.953158-310 (DFA torsion energy)
5834 EDFAN=     6.953158-310 (DFA NCa energy)
5835 EDFAB=     2.650815-317 (DFA Beta energy)
5836 ETOT=     -8.999497E+01 (total)
5837 RMS deviation from the reference structure:   3.174
5838  % of native contacts:  66.667
5839  % of nonnative contacts:  63.636
5840  contact order:   0.275
5841  TM-score with the reference structure:     0.30
5842  Conformation #         154  read
5843
5844
5845  Conformation #         149  sumsl return code            4
5846
5847 Virtual-chain energies:
5848
5849 EVDW=     -5.240783E+01 WEIGHT=    1.352790D+00 (SC-SC)
5850 EVDW2=     4.463085E+01 WEIGHT=    1.593040D+00 (SC-p)
5851 EES=      -7.976189E+01 WEIGHT=    7.153400D-01 (p-p)
5852 EVDWPP=   -3.251683E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5853 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5854 EBE=      -3.889342E+01 WEIGHT=    1.138730D+00 (bending)
5855 ESC=       3.021142E+01 WEIGHT=    1.625800D-01 (SC local)
5856 ETORS=     8.528170E+00 WEIGHT=    1.985990D+00 (torsional)
5857 ETORSD=   -1.299596E+00 WEIGHT=    1.570690D+00 (double torsional)
5858 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5859 ECORR4=   -6.016795E+01 WEIGHT=    4.288700D-01 (multi-body)
5860 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5861 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5862 EELLO=    -3.474699E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5863 ETURN3=    1.497701E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5864 ETURN4=   -9.726432E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
5865 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5866 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5867 EDIHC=     0.000000E+00 (dihedral angle constraints)
5868 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5869 UCONST=     0.000000E+00 (Constraint energy)
5870 EDFAD=     5.491269-315 (DFA distance energy)
5871 EDFAT=     6.953158-310 (DFA torsion energy)
5872 EDFAN=     6.953158-310 (DFA NCa energy)
5873 EDFAB=     2.650815-317 (DFA Beta energy)
5874 ETOT=     -8.619050E+01 (total)
5875 RMS deviation from the reference structure:   3.750
5876  % of native contacts:  41.667
5877  % of nonnative contacts:  76.190
5878  contact order:   0.390
5879  TM-score with the reference structure:     0.30
5880  Conformation #         155  read
5881
5882
5883  Conformation #         151  sumsl return code            4
5884
5885 Virtual-chain energies:
5886
5887 EVDW=     -5.330591E+01 WEIGHT=    1.352790D+00 (SC-SC)
5888 EVDW2=     4.282622E+01 WEIGHT=    1.593040D+00 (SC-p)
5889 EES=      -8.267678E+01 WEIGHT=    7.153400D-01 (p-p)
5890 EVDWPP=   -1.994737E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5891 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5892 EBE=      -3.994032E+01 WEIGHT=    1.138730D+00 (bending)
5893 ESC=       3.600043E+01 WEIGHT=    1.625800D-01 (SC local)
5894 ETORS=     9.243882E+00 WEIGHT=    1.985990D+00 (torsional)
5895 ETORSD=   -4.562866E-01 WEIGHT=    1.570690D+00 (double torsional)
5896 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5897 ECORR4=   -5.967925E+01 WEIGHT=    4.288700D-01 (multi-body)
5898 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5899 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5900 EELLO=     1.227015E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5901 ETURN3=    1.780265E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5902 ETURN4=   -1.050642E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5903 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5904 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5905 EDIHC=     0.000000E+00 (dihedral angle constraints)
5906 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5907 UCONST=     0.000000E+00 (Constraint energy)
5908 EDFAD=     5.491269-315 (DFA distance energy)
5909 EDFAT=     6.953158-310 (DFA torsion energy)
5910 EDFAN=     6.953158-310 (DFA NCa energy)
5911 EDFAB=     2.650815-317 (DFA Beta energy)
5912 ETOT=     -8.334150E+01 (total)
5913 RMS deviation from the reference structure:   4.003
5914  % of native contacts:  33.333
5915  % of nonnative contacts:  78.947
5916  contact order:   0.361
5917  TM-score with the reference structure:     0.28
5918  Conformation #         156  read
5919
5920
5921  Conformation #         153  sumsl return code            4
5922
5923 Virtual-chain energies:
5924
5925 EVDW=     -5.568476E+01 WEIGHT=    1.352790D+00 (SC-SC)
5926 EVDW2=     4.586922E+01 WEIGHT=    1.593040D+00 (SC-p)
5927 EES=      -8.771877E+01 WEIGHT=    7.153400D-01 (p-p)
5928 EVDWPP=   -2.086863E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5929 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5930 EBE=      -3.770630E+01 WEIGHT=    1.138730D+00 (bending)
5931 ESC=       4.192691E+01 WEIGHT=    1.625800D-01 (SC local)
5932 ETORS=     8.376770E+00 WEIGHT=    1.985990D+00 (torsional)
5933 ETORSD=   -3.042681E-01 WEIGHT=    1.570690D+00 (double torsional)
5934 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5935 ECORR4=   -6.628281E+01 WEIGHT=    4.288700D-01 (multi-body)
5936 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5937 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5938 EELLO=     3.792327E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
5939 ETURN3=    1.739286E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5940 ETURN4=   -2.555324E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5941 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5942 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5943 EDIHC=     0.000000E+00 (dihedral angle constraints)
5944 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5945 UCONST=     0.000000E+00 (Constraint energy)
5946 EDFAD=     5.491269-315 (DFA distance energy)
5947 EDFAT=     6.953158-310 (DFA torsion energy)
5948 EDFAN=     6.953158-310 (DFA NCa energy)
5949 EDFAB=     2.650815-317 (DFA Beta energy)
5950 ETOT=     -8.805524E+01 (total)
5951 RMS deviation from the reference structure:   4.108
5952  % of native contacts:  33.333
5953  % of nonnative contacts:  81.818
5954  contact order:   0.374
5955  TM-score with the reference structure:     0.27
5956  Conformation #         157  read
5957
5958
5959  Conformation #         148  sumsl return code            4
5960
5961 Virtual-chain energies:
5962
5963 EVDW=     -5.359528E+01 WEIGHT=    1.352790D+00 (SC-SC)
5964 EVDW2=     4.872944E+01 WEIGHT=    1.593040D+00 (SC-p)
5965 EES=      -8.716265E+01 WEIGHT=    7.153400D-01 (p-p)
5966 EVDWPP=   -3.501202E+01 WEIGHT=    1.137100D-01 (p-p VDW)
5967 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
5968 EBE=      -3.731413E+01 WEIGHT=    1.138730D+00 (bending)
5969 ESC=       4.018802E+01 WEIGHT=    1.625800D-01 (SC local)
5970 ETORS=     7.680232E+00 WEIGHT=    1.985990D+00 (torsional)
5971 ETORSD=   -8.194354E-01 WEIGHT=    1.570690D+00 (double torsional)
5972 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
5973 ECORR4=   -6.604564E+01 WEIGHT=    4.288700D-01 (multi-body)
5974 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5975 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
5976 EELLO=    -4.929471E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
5977 ETURN3=    1.525257E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
5978 ETURN4=   -1.007015E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
5979 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
5980 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
5981 EDIHC=     0.000000E+00 (dihedral angle constraints)
5982 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
5983 UCONST=     0.000000E+00 (Constraint energy)
5984 EDFAD=     5.491269-315 (DFA distance energy)
5985 EDFAT=     6.953158-310 (DFA torsion energy)
5986 EDFAN=     6.953158-310 (DFA NCa energy)
5987 EDFAB=     2.650815-317 (DFA Beta energy)
5988 ETOT=     -8.724651E+01 (total)
5989 RMS deviation from the reference structure:   3.544
5990  % of native contacts:  58.333
5991  % of nonnative contacts:  65.000
5992  contact order:   0.318
5993  TM-score with the reference structure:     0.28
5994  Conformation #         158  read
5995
5996
5997  Conformation #         130  sumsl return code            4
5998
5999 Virtual-chain energies:
6000
6001 EVDW=     -5.390323E+01 WEIGHT=    1.352790D+00 (SC-SC)
6002 EVDW2=     4.965018E+01 WEIGHT=    1.593040D+00 (SC-p)
6003 EES=      -1.013038E+02 WEIGHT=    7.153400D-01 (p-p)
6004 EVDWPP=   -1.566271E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6005 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6006 EBE=      -4.096682E+01 WEIGHT=    1.138730D+00 (bending)
6007 ESC=       4.208016E+01 WEIGHT=    1.625800D-01 (SC local)
6008 ETORS=     1.040712E+01 WEIGHT=    1.985990D+00 (torsional)
6009 ETORSD=   -3.597264E-01 WEIGHT=    1.570690D+00 (double torsional)
6010 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6011 ECORR4=   -6.941403E+01 WEIGHT=    4.288700D-01 (multi-body)
6012 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6013 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6014 EELLO=     1.127132E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6015 ETURN3=    1.979093E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6016 ETURN4=   -2.397899E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6017 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6018 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6019 EDIHC=     0.000000E+00 (dihedral angle constraints)
6020 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6021 UCONST=     0.000000E+00 (Constraint energy)
6022 EDFAD=     5.491269-315 (DFA distance energy)
6023 EDFAT=     6.953158-310 (DFA torsion energy)
6024 EDFAN=     6.953158-310 (DFA NCa energy)
6025 EDFAB=     2.650815-317 (DFA Beta energy)
6026 ETOT=     -8.556338E+01 (total)
6027 RMS deviation from the reference structure:   4.737
6028  % of native contacts:  25.000
6029  % of nonnative contacts:  84.211
6030  contact order:   0.323
6031  TM-score with the reference structure:     0.29
6032  Conformation #         159  read
6033
6034
6035  Conformation #         156  sumsl return code            4
6036
6037 Virtual-chain energies:
6038
6039 EVDW=     -5.177085E+01 WEIGHT=    1.352790D+00 (SC-SC)
6040 EVDW2=     4.780030E+01 WEIGHT=    1.593040D+00 (SC-p)
6041 EES=      -8.842148E+01 WEIGHT=    7.153400D-01 (p-p)
6042 EVDWPP=   -2.872680E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6043 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6044 EBE=      -3.856514E+01 WEIGHT=    1.138730D+00 (bending)
6045 ESC=       5.905370E+01 WEIGHT=    1.625800D-01 (SC local)
6046 ETORS=     7.244463E+00 WEIGHT=    1.985990D+00 (torsional)
6047 ETORSD=   -2.026760E+00 WEIGHT=    1.570690D+00 (double torsional)
6048 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6049 ECORR4=   -6.770924E+01 WEIGHT=    4.288700D-01 (multi-body)
6050 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6051 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6052 EELLO=     3.308956E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6053 ETURN3=    1.675430E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6054 ETURN4=   -7.432571E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6055 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6056 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6057 EDIHC=     0.000000E+00 (dihedral angle constraints)
6058 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6059 UCONST=     0.000000E+00 (Constraint energy)
6060 EDFAD=     5.491269-315 (DFA distance energy)
6061 EDFAT=     6.953158-310 (DFA torsion energy)
6062 EDFAN=     6.953158-310 (DFA NCa energy)
6063 EDFAB=     2.650815-317 (DFA Beta energy)
6064 ETOT=     -8.424746E+01 (total)
6065 RMS deviation from the reference structure:   5.387
6066  % of native contacts:  33.333
6067  % of nonnative contacts:  80.000
6068  contact order:   0.230
6069  TM-score with the reference structure:     0.29
6070  Conformation #         160  read
6071
6072
6073  Conformation #         154  sumsl return code            4
6074
6075 Virtual-chain energies:
6076
6077 EVDW=     -5.249458E+01 WEIGHT=    1.352790D+00 (SC-SC)
6078 EVDW2=     4.202808E+01 WEIGHT=    1.593040D+00 (SC-p)
6079 EES=      -7.768082E+01 WEIGHT=    7.153400D-01 (p-p)
6080 EVDWPP=   -2.826384E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6081 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6082 EBE=      -3.674698E+01 WEIGHT=    1.138730D+00 (bending)
6083 ESC=       2.612357E+01 WEIGHT=    1.625800D-01 (SC local)
6084 ETORS=     7.760077E+00 WEIGHT=    1.985990D+00 (torsional)
6085 ETORSD=   -1.921347E+00 WEIGHT=    1.570690D+00 (double torsional)
6086 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6087 ECORR4=   -5.787341E+01 WEIGHT=    4.288700D-01 (multi-body)
6088 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6089 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6090 EELLO=     6.220704E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
6091 ETURN3=    1.592056E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6092 ETURN4=    5.023273E-02 WEIGHT=    6.623000D-01 (turns, 4th order)
6093 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6094 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6095 EDIHC=     0.000000E+00 (dihedral angle constraints)
6096 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6097 UCONST=     0.000000E+00 (Constraint energy)
6098 EDFAD=     5.491269-315 (DFA distance energy)
6099 EDFAT=     6.953158-310 (DFA torsion energy)
6100 EDFAN=     6.953158-310 (DFA NCa energy)
6101 EDFAB=     2.650815-317 (DFA Beta energy)
6102 ETOT=     -8.587361E+01 (total)
6103 RMS deviation from the reference structure:   4.128
6104  % of native contacts:  25.000
6105  % of nonnative contacts:  85.714
6106  contact order:   0.405
6107  TM-score with the reference structure:     0.26
6108  Conformation #         161  read
6109
6110
6111  Conformation #         160  sumsl return code            4
6112
6113 Virtual-chain energies:
6114
6115 EVDW=     -5.228110E+01 WEIGHT=    1.352790D+00 (SC-SC)
6116 EVDW2=     4.964238E+01 WEIGHT=    1.593040D+00 (SC-p)
6117 EES=      -9.320658E+01 WEIGHT=    7.153400D-01 (p-p)
6118 EVDWPP=   -2.852559E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6119 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6120 EBE=      -3.819485E+01 WEIGHT=    1.138730D+00 (bending)
6121 ESC=       4.190529E+01 WEIGHT=    1.625800D-01 (SC local)
6122 ETORS=     8.954317E+00 WEIGHT=    1.985990D+00 (torsional)
6123 ETORSD=   -2.031568E+00 WEIGHT=    1.570690D+00 (double torsional)
6124 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6125 ECORR4=   -6.496078E+01 WEIGHT=    4.288700D-01 (multi-body)
6126 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6127 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6128 EELLO=    -2.981499E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
6129 ETURN3=    1.625952E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6130 ETURN4=    4.057457E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6131 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6132 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6133 EDIHC=     0.000000E+00 (dihedral angle constraints)
6134 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6135 UCONST=     0.000000E+00 (Constraint energy)
6136 EDFAD=     5.491269-315 (DFA distance energy)
6137 EDFAT=     6.953158-310 (DFA torsion energy)
6138 EDFAN=     6.953158-310 (DFA NCa energy)
6139 EDFAB=     2.650815-317 (DFA Beta energy)
6140 ETOT=     -8.385496E+01 (total)
6141 RMS deviation from the reference structure:   4.542
6142  % of native contacts:  41.667
6143  % of nonnative contacts:  76.190
6144  contact order:   0.294
6145  TM-score with the reference structure:     0.28
6146  Conformation #         162  read
6147
6148
6149  Conformation #         155  sumsl return code            4
6150
6151 Virtual-chain energies:
6152
6153 EVDW=     -5.102233E+01 WEIGHT=    1.352790D+00 (SC-SC)
6154 EVDW2=     5.347376E+01 WEIGHT=    1.593040D+00 (SC-p)
6155 EES=      -1.144757E+02 WEIGHT=    7.153400D-01 (p-p)
6156 EVDWPP=   -2.469975E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6157 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6158 EBE=      -4.098015E+01 WEIGHT=    1.138730D+00 (bending)
6159 ESC=       3.814724E+01 WEIGHT=    1.625800D-01 (SC local)
6160 ETORS=     1.388686E+01 WEIGHT=    1.985990D+00 (torsional)
6161 ETORSD=    1.982969E+00 WEIGHT=    1.570690D+00 (double torsional)
6162 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6163 ECORR4=   -8.096849E+01 WEIGHT=    4.288700D-01 (multi-body)
6164 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6165 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6166 EELLO=    -7.687537E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6167 ETURN3=    1.882570E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6168 ETURN4=   -1.959563E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6169 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6170 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6171 EDIHC=     0.000000E+00 (dihedral angle constraints)
6172 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6173 UCONST=     0.000000E+00 (Constraint energy)
6174 EDFAD=     5.491269-315 (DFA distance energy)
6175 EDFAT=     6.953158-310 (DFA torsion energy)
6176 EDFAN=     6.953158-310 (DFA NCa energy)
6177 EDFAB=     2.650815-317 (DFA Beta energy)
6178 ETOT=     -8.379634E+01 (total)
6179 RMS deviation from the reference structure:   3.185
6180  % of native contacts:  33.333
6181  % of nonnative contacts:  80.000
6182  contact order:   0.291
6183  TM-score with the reference structure:     0.39
6184  Conformation #         163  read
6185
6186
6187  Conformation #         161  sumsl return code            4
6188
6189 Virtual-chain energies:
6190
6191 EVDW=     -5.365628E+01 WEIGHT=    1.352790D+00 (SC-SC)
6192 EVDW2=     4.783546E+01 WEIGHT=    1.593040D+00 (SC-p)
6193 EES=      -8.158648E+01 WEIGHT=    7.153400D-01 (p-p)
6194 EVDWPP=   -4.130713E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6195 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6196 EBE=      -3.800202E+01 WEIGHT=    1.138730D+00 (bending)
6197 ESC=       3.046997E+01 WEIGHT=    1.625800D-01 (SC local)
6198 ETORS=     7.342562E+00 WEIGHT=    1.985990D+00 (torsional)
6199 ETORSD=    8.754059E-02 WEIGHT=    1.570690D+00 (double torsional)
6200 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6201 ECORR4=   -6.094880E+01 WEIGHT=    4.288700D-01 (multi-body)
6202 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6203 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6204 EELLO=    -5.988711E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6205 ETURN3=    1.313683E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6206 ETURN4=   -1.659103E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6207 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6208 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6209 EDIHC=     0.000000E+00 (dihedral angle constraints)
6210 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6211 UCONST=     0.000000E+00 (Constraint energy)
6212 EDFAD=     5.491269-315 (DFA distance energy)
6213 EDFAT=     6.953158-310 (DFA torsion energy)
6214 EDFAN=     6.953158-310 (DFA NCa energy)
6215 EDFAB=     2.650815-317 (DFA Beta energy)
6216 ETOT=     -8.907503E+01 (total)
6217 RMS deviation from the reference structure:   3.731
6218  % of native contacts:  41.667
6219  % of nonnative contacts:  78.261
6220  contact order:   0.399
6221  TM-score with the reference structure:     0.29
6222  Conformation #         164  read
6223
6224
6225  Conformation #         162  sumsl return code            4
6226
6227 Virtual-chain energies:
6228
6229 EVDW=     -5.297196E+01 WEIGHT=    1.352790D+00 (SC-SC)
6230 EVDW2=     4.274867E+01 WEIGHT=    1.593040D+00 (SC-p)
6231 EES=      -8.752295E+01 WEIGHT=    7.153400D-01 (p-p)
6232 EVDWPP=   -2.449538E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6233 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6234 EBE=      -3.874635E+01 WEIGHT=    1.138730D+00 (bending)
6235 ESC=       3.442256E+01 WEIGHT=    1.625800D-01 (SC local)
6236 ETORS=     9.875904E+00 WEIGHT=    1.985990D+00 (torsional)
6237 ETORSD=   -1.381948E+00 WEIGHT=    1.570690D+00 (double torsional)
6238 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6239 ECORR4=   -6.481657E+01 WEIGHT=    4.288700D-01 (multi-body)
6240 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6241 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6242 EELLO=    -2.104344E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6243 ETURN3=    1.906658E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6244 ETURN4=   -1.688883E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6245 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6246 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6247 EDIHC=     0.000000E+00 (dihedral angle constraints)
6248 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6249 UCONST=     0.000000E+00 (Constraint energy)
6250 EDFAD=     5.491269-315 (DFA distance energy)
6251 EDFAT=     6.953158-310 (DFA torsion energy)
6252 EDFAN=     6.953158-310 (DFA NCa energy)
6253 EDFAB=     2.650815-317 (DFA Beta energy)
6254 ETOT=     -8.712038E+01 (total)
6255 RMS deviation from the reference structure:   3.306
6256  % of native contacts:  41.667
6257  % of nonnative contacts:  76.190
6258  contact order:   0.333
6259  TM-score with the reference structure:     0.30
6260  Conformation #         165  read
6261
6262
6263  Conformation #         158  sumsl return code            4
6264
6265 Virtual-chain energies:
6266
6267 EVDW=     -5.595937E+01 WEIGHT=    1.352790D+00 (SC-SC)
6268 EVDW2=     4.650320E+01 WEIGHT=    1.593040D+00 (SC-p)
6269 EES=      -8.998371E+01 WEIGHT=    7.153400D-01 (p-p)
6270 EVDWPP=   -2.278375E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6271 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6272 EBE=      -3.883679E+01 WEIGHT=    1.138730D+00 (bending)
6273 ESC=       4.943238E+01 WEIGHT=    1.625800D-01 (SC local)
6274 ETORS=     1.043145E+01 WEIGHT=    1.985990D+00 (torsional)
6275 ETORSD=   -1.731760E+00 WEIGHT=    1.570690D+00 (double torsional)
6276 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6277 ECORR4=   -6.305491E+01 WEIGHT=    4.288700D-01 (multi-body)
6278 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6279 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6280 EELLO=     1.827503E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6281 ETURN3=    1.947147E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6282 ETURN4=   -5.488167E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6283 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6284 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6285 EDIHC=     0.000000E+00 (dihedral angle constraints)
6286 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6287 UCONST=     0.000000E+00 (Constraint energy)
6288 EDFAD=     5.491269-315 (DFA distance energy)
6289 EDFAT=     6.953158-310 (DFA torsion energy)
6290 EDFAN=     6.953158-310 (DFA NCa energy)
6291 EDFAB=     2.650815-317 (DFA Beta energy)
6292 ETOT=     -8.430218E+01 (total)
6293 RMS deviation from the reference structure:   7.144
6294  % of native contacts:  16.667
6295  % of nonnative contacts:  90.000
6296  contact order:   0.270
6297  TM-score with the reference structure:     0.30
6298  Conformation #         166  read
6299
6300
6301  Conformation #         165  sumsl return code            4
6302
6303 Virtual-chain energies:
6304
6305 EVDW=     -5.153044E+01 WEIGHT=    1.352790D+00 (SC-SC)
6306 EVDW2=     3.612537E+01 WEIGHT=    1.593040D+00 (SC-p)
6307 EES=      -6.648725E+01 WEIGHT=    7.153400D-01 (p-p)
6308 EVDWPP=   -2.668271E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6309 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6310 EBE=      -3.891116E+01 WEIGHT=    1.138730D+00 (bending)
6311 ESC=       3.558682E+01 WEIGHT=    1.625800D-01 (SC local)
6312 ETORS=     8.961967E+00 WEIGHT=    1.985990D+00 (torsional)
6313 ETORSD=   -2.282324E+00 WEIGHT=    1.570690D+00 (double torsional)
6314 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6315 ECORR4=   -4.938073E+01 WEIGHT=    4.288700D-01 (multi-body)
6316 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6317 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6318 EELLO=     4.734051E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
6319 ETURN3=    1.432445E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6320 ETURN4=    3.015546E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6321 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6322 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6323 EDIHC=     0.000000E+00 (dihedral angle constraints)
6324 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6325 UCONST=     0.000000E+00 (Constraint energy)
6326 EDFAD=     5.491269-315 (DFA distance energy)
6327 EDFAT=     6.953158-310 (DFA torsion energy)
6328 EDFAN=     6.953158-310 (DFA NCa energy)
6329 EDFAB=     2.650815-317 (DFA Beta energy)
6330 ETOT=     -8.379960E+01 (total)
6331 RMS deviation from the reference structure:   5.136
6332  % of native contacts:  33.333
6333  % of nonnative contacts:  78.947
6334  contact order:   0.361
6335  TM-score with the reference structure:     0.29
6336  Conformation #         167  read
6337
6338
6339  Conformation #         157  sumsl return code            4
6340
6341 Virtual-chain energies:
6342
6343 EVDW=     -5.147873E+01 WEIGHT=    1.352790D+00 (SC-SC)
6344 EVDW2=     4.633755E+01 WEIGHT=    1.593040D+00 (SC-p)
6345 EES=      -9.433905E+01 WEIGHT=    7.153400D-01 (p-p)
6346 EVDWPP=   -2.368798E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6347 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6348 EBE=      -4.131301E+01 WEIGHT=    1.138730D+00 (bending)
6349 ESC=       3.049782E+01 WEIGHT=    1.625800D-01 (SC local)
6350 ETORS=     1.189233E+01 WEIGHT=    1.985990D+00 (torsional)
6351 ETORSD=   -1.181067E+00 WEIGHT=    1.570690D+00 (double torsional)
6352 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6353 ECORR4=   -6.699182E+01 WEIGHT=    4.288700D-01 (multi-body)
6354 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6355 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6356 EELLO=    -2.127157E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6357 ETURN3=    1.639522E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6358 ETURN4=    1.167567E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6359 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6360 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6361 EDIHC=     0.000000E+00 (dihedral angle constraints)
6362 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6363 UCONST=     0.000000E+00 (Constraint energy)
6364 EDFAD=     5.491269-315 (DFA distance energy)
6365 EDFAT=     6.953158-310 (DFA torsion energy)
6366 EDFAN=     6.953158-310 (DFA NCa energy)
6367 EDFAB=     2.650815-317 (DFA Beta energy)
6368 ETOT=     -8.695974E+01 (total)
6369 RMS deviation from the reference structure:   3.789
6370  % of native contacts:  33.333
6371  % of nonnative contacts:  80.000
6372  contact order:   0.393
6373  TM-score with the reference structure:     0.26
6374  Conformation #         168  read
6375
6376
6377  Conformation #         163  sumsl return code            4
6378
6379 Virtual-chain energies:
6380
6381 EVDW=     -5.413799E+01 WEIGHT=    1.352790D+00 (SC-SC)
6382 EVDW2=     4.954929E+01 WEIGHT=    1.593040D+00 (SC-p)
6383 EES=      -9.679368E+01 WEIGHT=    7.153400D-01 (p-p)
6384 EVDWPP=   -2.856542E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6385 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6386 EBE=      -4.094072E+01 WEIGHT=    1.138730D+00 (bending)
6387 ESC=       2.949066E+01 WEIGHT=    1.625800D-01 (SC local)
6388 ETORS=     1.011359E+01 WEIGHT=    1.985990D+00 (torsional)
6389 ETORSD=    1.502252E+00 WEIGHT=    1.570690D+00 (double torsional)
6390 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6391 ECORR4=   -6.710760E+01 WEIGHT=    4.288700D-01 (multi-body)
6392 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6393 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6394 EELLO=    -4.606871E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6395 ETURN3=    1.617372E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6396 ETURN4=    7.685175E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6397 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6398 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6399 EDIHC=     0.000000E+00 (dihedral angle constraints)
6400 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6401 UCONST=     0.000000E+00 (Constraint energy)
6402 EDFAD=     5.491269-315 (DFA distance energy)
6403 EDFAT=     6.953158-310 (DFA torsion energy)
6404 EDFAN=     6.953158-310 (DFA NCa energy)
6405 EDFAB=     2.650815-317 (DFA Beta energy)
6406 ETOT=     -8.789425E+01 (total)
6407 RMS deviation from the reference structure:   4.237
6408  % of native contacts:  33.333
6409  % of nonnative contacts:  81.818
6410  contact order:   0.382
6411  TM-score with the reference structure:     0.22
6412  Conformation #         169  read
6413
6414
6415  Conformation #         167  sumsl return code            4
6416
6417 Virtual-chain energies:
6418
6419 EVDW=     -5.233602E+01 WEIGHT=    1.352790D+00 (SC-SC)
6420 EVDW2=     4.579518E+01 WEIGHT=    1.593040D+00 (SC-p)
6421 EES=      -8.564827E+01 WEIGHT=    7.153400D-01 (p-p)
6422 EVDWPP=   -3.120805E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6423 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6424 EBE=      -3.894785E+01 WEIGHT=    1.138730D+00 (bending)
6425 ESC=       4.277435E+01 WEIGHT=    1.625800D-01 (SC local)
6426 ETORS=     7.104415E+00 WEIGHT=    1.985990D+00 (torsional)
6427 ETORSD=    6.917291E-01 WEIGHT=    1.570690D+00 (double torsional)
6428 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6429 ECORR4=   -6.483157E+01 WEIGHT=    4.288700D-01 (multi-body)
6430 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6431 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6432 EELLO=    -3.661002E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6433 ETURN3=    1.583285E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6434 ETURN4=   -2.424840E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6435 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6436 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6437 EDIHC=     0.000000E+00 (dihedral angle constraints)
6438 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6439 UCONST=     0.000000E+00 (Constraint energy)
6440 EDFAD=     5.491269-315 (DFA distance energy)
6441 EDFAT=     6.953158-310 (DFA torsion energy)
6442 EDFAN=     6.953158-310 (DFA NCa energy)
6443 EDFAB=     2.650815-317 (DFA Beta energy)
6444 ETOT=     -8.814729E+01 (total)
6445 RMS deviation from the reference structure:   2.874
6446  % of native contacts:  50.000
6447  % of nonnative contacts:  68.421
6448  contact order:   0.280
6449  TM-score with the reference structure:     0.30
6450  Conformation #         170  read
6451
6452
6453  Conformation #         164  sumsl return code            4
6454
6455 Virtual-chain energies:
6456
6457 EVDW=     -5.312852E+01 WEIGHT=    1.352790D+00 (SC-SC)
6458 EVDW2=     4.463897E+01 WEIGHT=    1.593040D+00 (SC-p)
6459 EES=      -8.414070E+01 WEIGHT=    7.153400D-01 (p-p)
6460 EVDWPP=   -3.016515E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6461 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6462 EBE=      -3.651662E+01 WEIGHT=    1.138730D+00 (bending)
6463 ESC=       2.544658E+01 WEIGHT=    1.625800D-01 (SC local)
6464 ETORS=     8.549284E+00 WEIGHT=    1.985990D+00 (torsional)
6465 ETORSD=   -1.278552E+00 WEIGHT=    1.570690D+00 (double torsional)
6466 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6467 ECORR4=   -6.113391E+01 WEIGHT=    4.288700D-01 (multi-body)
6468 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6469 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6470 EELLO=     4.911480E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6471 ETURN3=    1.596057E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6472 ETURN4=    2.485834E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6473 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6474 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6475 EDIHC=     0.000000E+00 (dihedral angle constraints)
6476 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6477 UCONST=     0.000000E+00 (Constraint energy)
6478 EDFAD=     5.491269-315 (DFA distance energy)
6479 EDFAT=     6.953158-310 (DFA torsion energy)
6480 EDFAN=     6.953158-310 (DFA NCa energy)
6481 EDFAB=     2.650815-317 (DFA Beta energy)
6482 ETOT=     -8.370977E+01 (total)
6483 RMS deviation from the reference structure:   2.832
6484  % of native contacts:  66.667
6485  % of nonnative contacts:  57.895
6486  contact order:   0.344
6487  TM-score with the reference structure:     0.28
6488  Conformation #         171  read
6489
6490
6491  Conformation #         169  sumsl return code            4
6492
6493 Virtual-chain energies:
6494
6495 EVDW=     -5.590786E+01 WEIGHT=    1.352790D+00 (SC-SC)
6496 EVDW2=     5.996003E+01 WEIGHT=    1.593040D+00 (SC-p)
6497 EES=      -1.141322E+02 WEIGHT=    7.153400D-01 (p-p)
6498 EVDWPP=   -2.105772E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6499 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6500 EBE=      -3.856141E+01 WEIGHT=    1.138730D+00 (bending)
6501 ESC=       3.525815E+01 WEIGHT=    1.625800D-01 (SC local)
6502 ETORS=     1.175111E+01 WEIGHT=    1.985990D+00 (torsional)
6503 ETORSD=    3.341056E-01 WEIGHT=    1.570690D+00 (double torsional)
6504 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6505 ECORR4=   -8.130017E+01 WEIGHT=    4.288700D-01 (multi-body)
6506 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6507 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6508 EELLO=    -1.773832E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6509 ETURN3=    1.723996E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6510 ETURN4=   -2.174814E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6511 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6512 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6513 EDIHC=     0.000000E+00 (dihedral angle constraints)
6514 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6515 UCONST=     0.000000E+00 (Constraint energy)
6516 EDFAD=     5.491269-315 (DFA distance energy)
6517 EDFAT=     6.953158-310 (DFA torsion energy)
6518 EDFAN=     6.953158-310 (DFA NCa energy)
6519 EDFAB=     2.650815-317 (DFA Beta energy)
6520 ETOT=     -8.467517E+01 (total)
6521 RMS deviation from the reference structure:   4.091
6522  % of native contacts:  33.333
6523  % of nonnative contacts:  84.615
6524  contact order:   0.348
6525  TM-score with the reference structure:     0.29
6526  Conformation #         172  read
6527
6528
6529  Conformation #         171  sumsl return code            4
6530
6531 Virtual-chain energies:
6532
6533 EVDW=     -5.217333E+01 WEIGHT=    1.352790D+00 (SC-SC)
6534 EVDW2=     5.316804E+01 WEIGHT=    1.593040D+00 (SC-p)
6535 EES=      -1.069891E+02 WEIGHT=    7.153400D-01 (p-p)
6536 EVDWPP=   -2.892219E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6537 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6538 EBE=      -3.772521E+01 WEIGHT=    1.138730D+00 (bending)
6539 ESC=       4.511985E+01 WEIGHT=    1.625800D-01 (SC local)
6540 ETORS=     1.107330E+01 WEIGHT=    1.985990D+00 (torsional)
6541 ETORSD=   -1.383298E+00 WEIGHT=    1.570690D+00 (double torsional)
6542 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6543 ECORR4=   -8.063446E+01 WEIGHT=    4.288700D-01 (multi-body)
6544 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6545 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6546 EELLO=    -6.405735E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6547 ETURN3=    1.858560E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6548 ETURN4=    4.244372E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6549 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6550 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6551 EDIHC=     0.000000E+00 (dihedral angle constraints)
6552 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6553 UCONST=     0.000000E+00 (Constraint energy)
6554 EDFAD=     5.491269-315 (DFA distance energy)
6555 EDFAT=     6.953158-310 (DFA torsion energy)
6556 EDFAN=     6.953158-310 (DFA NCa energy)
6557 EDFAB=     2.650815-317 (DFA Beta energy)
6558 ETOT=     -8.547741E+01 (total)
6559 RMS deviation from the reference structure:   3.320
6560  % of native contacts:  16.667
6561  % of nonnative contacts:  88.235
6562  contact order:   0.214
6563  TM-score with the reference structure:     0.30
6564  Conformation #         173  read
6565
6566
6567  Conformation #         168  sumsl return code            4
6568
6569 Virtual-chain energies:
6570
6571 EVDW=     -5.458792E+01 WEIGHT=    1.352790D+00 (SC-SC)
6572 EVDW2=     4.766625E+01 WEIGHT=    1.593040D+00 (SC-p)
6573 EES=      -9.173334E+01 WEIGHT=    7.153400D-01 (p-p)
6574 EVDWPP=   -2.962082E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6575 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6576 EBE=      -3.686264E+01 WEIGHT=    1.138730D+00 (bending)
6577 ESC=       4.840521E+01 WEIGHT=    1.625800D-01 (SC local)
6578 ETORS=     7.603433E+00 WEIGHT=    1.985990D+00 (torsional)
6579 ETORSD=    1.583762E-01 WEIGHT=    1.570690D+00 (double torsional)
6580 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6581 ECORR4=   -6.969779E+01 WEIGHT=    4.288700D-01 (multi-body)
6582 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6583 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6584 EELLO=    -5.235385E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6585 ETURN3=    1.642394E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6586 ETURN4=   -1.159022E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6587 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6588 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6589 EDIHC=     0.000000E+00 (dihedral angle constraints)
6590 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6591 UCONST=     0.000000E+00 (Constraint energy)
6592 EDFAD=     5.491269-315 (DFA distance energy)
6593 EDFAT=     6.953158-310 (DFA torsion energy)
6594 EDFAN=     6.953158-310 (DFA NCa energy)
6595 EDFAB=     2.650815-317 (DFA Beta energy)
6596 ETOT=     -8.944589E+01 (total)
6597 RMS deviation from the reference structure:   3.337
6598  % of native contacts:  66.667
6599  % of nonnative contacts:  65.217
6600  contact order:   0.292
6601  TM-score with the reference structure:     0.32
6602  Conformation #         174  read
6603
6604
6605  Conformation #         172  sumsl return code            4
6606
6607 Virtual-chain energies:
6608
6609 EVDW=     -4.839551E+01 WEIGHT=    1.352790D+00 (SC-SC)
6610 EVDW2=     4.889262E+01 WEIGHT=    1.593040D+00 (SC-p)
6611 EES=      -9.598909E+01 WEIGHT=    7.153400D-01 (p-p)
6612 EVDWPP=   -2.184953E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6613 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6614 EBE=      -4.052573E+01 WEIGHT=    1.138730D+00 (bending)
6615 ESC=       3.004370E+01 WEIGHT=    1.625800D-01 (SC local)
6616 ETORS=     8.767030E+00 WEIGHT=    1.985990D+00 (torsional)
6617 ETORSD=   -1.798934E+00 WEIGHT=    1.570690D+00 (double torsional)
6618 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6619 ECORR4=   -6.964763E+01 WEIGHT=    4.288700D-01 (multi-body)
6620 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6621 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6622 EELLO=    -3.281299E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6623 ETURN3=    1.899748E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6624 ETURN4=   -1.694982E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6625 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6626 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6627 EDIHC=     0.000000E+00 (dihedral angle constraints)
6628 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6629 UCONST=     0.000000E+00 (Constraint energy)
6630 EDFAD=     5.491269-315 (DFA distance energy)
6631 EDFAT=     6.953158-310 (DFA torsion energy)
6632 EDFAN=     6.953158-310 (DFA NCa energy)
6633 EDFAB=     2.650815-317 (DFA Beta energy)
6634 ETOT=     -8.487372E+01 (total)
6635 RMS deviation from the reference structure:   4.975
6636  % of native contacts:  25.000
6637  % of nonnative contacts:  84.211
6638  contact order:   0.347
6639  TM-score with the reference structure:     0.29
6640  Conformation #         175  read
6641
6642
6643  Conformation #         173  sumsl return code            4
6644
6645 Virtual-chain energies:
6646
6647 EVDW=     -5.015018E+01 WEIGHT=    1.352790D+00 (SC-SC)
6648 EVDW2=     5.113216E+01 WEIGHT=    1.593040D+00 (SC-p)
6649 EES=      -9.474292E+01 WEIGHT=    7.153400D-01 (p-p)
6650 EVDWPP=   -2.682747E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6651 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6652 EBE=      -4.151050E+01 WEIGHT=    1.138730D+00 (bending)
6653 ESC=       3.973033E+01 WEIGHT=    1.625800D-01 (SC local)
6654 ETORS=     1.190882E+01 WEIGHT=    1.985990D+00 (torsional)
6655 ETORSD=   -2.688992E+00 WEIGHT=    1.570690D+00 (double torsional)
6656 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6657 ECORR4=   -7.420177E+01 WEIGHT=    4.288700D-01 (multi-body)
6658 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6659 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6660 EELLO=     1.938192E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6661 ETURN3=    1.491486E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6662 ETURN4=    2.365172E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6663 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6664 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6665 EDIHC=     0.000000E+00 (dihedral angle constraints)
6666 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6667 UCONST=     0.000000E+00 (Constraint energy)
6668 EDFAD=     5.491269-315 (DFA distance energy)
6669 EDFAT=     6.953158-310 (DFA torsion energy)
6670 EDFAN=     6.953158-310 (DFA NCa energy)
6671 EDFAB=     2.650815-317 (DFA Beta energy)
6672 ETOT=     -8.337470E+01 (total)
6673 RMS deviation from the reference structure:   3.069
6674  % of native contacts:  66.667
6675  % of nonnative contacts:  60.000
6676  contact order:   0.389
6677  TM-score with the reference structure:     0.26
6678  Conformation #         176  read
6679
6680
6681  Conformation #         175  sumsl return code            4
6682
6683 Virtual-chain energies:
6684
6685 EVDW=     -5.137608E+01 WEIGHT=    1.352790D+00 (SC-SC)
6686 EVDW2=     3.959961E+01 WEIGHT=    1.593040D+00 (SC-p)
6687 EES=      -6.740231E+01 WEIGHT=    7.153400D-01 (p-p)
6688 EVDWPP=   -2.806596E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6689 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6690 EBE=      -3.958164E+01 WEIGHT=    1.138730D+00 (bending)
6691 ESC=       3.555227E+01 WEIGHT=    1.625800D-01 (SC local)
6692 ETORS=     8.263582E+00 WEIGHT=    1.985990D+00 (torsional)
6693 ETORSD=   -2.735830E+00 WEIGHT=    1.570690D+00 (double torsional)
6694 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6695 ECORR4=   -5.165243E+01 WEIGHT=    4.288700D-01 (multi-body)
6696 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6697 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6698 EELLO=     5.493571E-02 WEIGHT=    1.603600D-01 (electrostatic-local)
6699 ETURN3=    1.400653E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6700 ETURN4=   -1.689443E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6701 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6702 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6703 EDIHC=     0.000000E+00 (dihedral angle constraints)
6704 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6705 UCONST=     0.000000E+00 (Constraint energy)
6706 EDFAD=     5.491269-315 (DFA distance energy)
6707 EDFAT=     6.953158-310 (DFA torsion energy)
6708 EDFAN=     6.953158-310 (DFA NCa energy)
6709 EDFAB=     2.650815-317 (DFA Beta energy)
6710 ETOT=     -8.362585E+01 (total)
6711 RMS deviation from the reference structure:   5.668
6712  % of native contacts:  33.333
6713  % of nonnative contacts:  78.947
6714  contact order:   0.304
6715  TM-score with the reference structure:     0.33
6716  Conformation #         177  read
6717
6718
6719  Conformation #         176  sumsl return code            4
6720
6721 Virtual-chain energies:
6722
6723 EVDW=     -5.116541E+01 WEIGHT=    1.352790D+00 (SC-SC)
6724 EVDW2=     3.886986E+01 WEIGHT=    1.593040D+00 (SC-p)
6725 EES=      -7.097200E+01 WEIGHT=    7.153400D-01 (p-p)
6726 EVDWPP=   -2.484384E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6727 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6728 EBE=      -3.784236E+01 WEIGHT=    1.138730D+00 (bending)
6729 ESC=       2.527404E+01 WEIGHT=    1.625800D-01 (SC local)
6730 ETORS=     7.281871E+00 WEIGHT=    1.985990D+00 (torsional)
6731 ETORSD=   -1.724432E+00 WEIGHT=    1.570690D+00 (double torsional)
6732 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6733 ECORR4=   -5.411084E+01 WEIGHT=    4.288700D-01 (multi-body)
6734 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6735 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6736 EELLO=    -9.192385E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
6737 ETURN3=    1.497576E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6738 ETURN4=   -3.383636E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
6739 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6740 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6741 EDIHC=     0.000000E+00 (dihedral angle constraints)
6742 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6743 UCONST=     0.000000E+00 (Constraint energy)
6744 EDFAD=     5.491269-315 (DFA distance energy)
6745 EDFAT=     6.953158-310 (DFA torsion energy)
6746 EDFAN=     6.953158-310 (DFA NCa energy)
6747 EDFAB=     2.650815-317 (DFA Beta energy)
6748 ETOT=     -8.642955E+01 (total)
6749 RMS deviation from the reference structure:   4.518
6750  % of native contacts:  33.333
6751  % of nonnative contacts:  80.952
6752  contact order:   0.400
6753  TM-score with the reference structure:     0.28
6754  Conformation #         178  read
6755
6756
6757  Conformation #         174  sumsl return code            4
6758
6759 Virtual-chain energies:
6760
6761 EVDW=     -4.974373E+01 WEIGHT=    1.352790D+00 (SC-SC)
6762 EVDW2=     6.138525E+01 WEIGHT=    1.593040D+00 (SC-p)
6763 EES=      -1.211905E+02 WEIGHT=    7.153400D-01 (p-p)
6764 EVDWPP=   -1.711596E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6765 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6766 EBE=      -3.653085E+01 WEIGHT=    1.138730D+00 (bending)
6767 ESC=       4.770948E+01 WEIGHT=    1.625800D-01 (SC local)
6768 ETORS=     1.186215E+01 WEIGHT=    1.985990D+00 (torsional)
6769 ETORSD=   -2.161311E+00 WEIGHT=    1.570690D+00 (double torsional)
6770 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6771 ECORR4=   -9.444611E+01 WEIGHT=    4.288700D-01 (multi-body)
6772 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6773 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6774 EELLO=    -8.220799E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6775 ETURN3=    1.774770E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6776 ETURN4=   -5.603053E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6777 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6778 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6779 EDIHC=     0.000000E+00 (dihedral angle constraints)
6780 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6781 UCONST=     0.000000E+00 (Constraint energy)
6782 EDFAD=     5.491269-315 (DFA distance energy)
6783 EDFAT=     6.953158-310 (DFA torsion energy)
6784 EDFAN=     6.953158-310 (DFA NCa energy)
6785 EDFAB=     2.650815-317 (DFA Beta energy)
6786 ETOT=     -8.741118E+01 (total)
6787 RMS deviation from the reference structure:   3.130
6788  % of native contacts:  58.333
6789  % of nonnative contacts:  66.667
6790  contact order:   0.286
6791  TM-score with the reference structure:     0.29
6792  Conformation #         179  read
6793
6794
6795  Conformation #         178  sumsl return code            4
6796
6797 Virtual-chain energies:
6798
6799 EVDW=     -4.943524E+01 WEIGHT=    1.352790D+00 (SC-SC)
6800 EVDW2=     3.215555E+01 WEIGHT=    1.593040D+00 (SC-p)
6801 EES=      -4.837296E+01 WEIGHT=    7.153400D-01 (p-p)
6802 EVDWPP=   -3.382279E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6803 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6804 EBE=      -3.905375E+01 WEIGHT=    1.138730D+00 (bending)
6805 ESC=       3.200207E+01 WEIGHT=    1.625800D-01 (SC local)
6806 ETORS=     4.610563E+00 WEIGHT=    1.985990D+00 (torsional)
6807 ETORSD=   -5.186061E-01 WEIGHT=    1.570690D+00 (double torsional)
6808 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6809 ECORR4=   -3.289182E+01 WEIGHT=    4.288700D-01 (multi-body)
6810 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6811 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6812 EELLO=     2.475586E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6813 ETURN3=    9.173592E+00 WEIGHT=    1.687220D+00 (turns, 3rd order)
6814 ETURN4=   -1.560247E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6815 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6816 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6817 EDIHC=     0.000000E+00 (dihedral angle constraints)
6818 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6819 UCONST=     0.000000E+00 (Constraint energy)
6820 EDFAD=     5.491269-315 (DFA distance energy)
6821 EDFAT=     6.953158-310 (DFA torsion energy)
6822 EDFAN=     6.953158-310 (DFA NCa energy)
6823 EDFAB=     2.650815-317 (DFA Beta energy)
6824 ETOT=     -8.429116E+01 (total)
6825 RMS deviation from the reference structure:   5.777
6826  % of native contacts:  33.333
6827  % of nonnative contacts:  71.429
6828  contact order:   0.370
6829  TM-score with the reference structure:     0.26
6830  Conformation #         180  read
6831
6832
6833  Conformation #         170  sumsl return code            4
6834
6835 Virtual-chain energies:
6836
6837 EVDW=     -5.102378E+01 WEIGHT=    1.352790D+00 (SC-SC)
6838 EVDW2=     4.020422E+01 WEIGHT=    1.593040D+00 (SC-p)
6839 EES=      -8.113166E+01 WEIGHT=    7.153400D-01 (p-p)
6840 EVDWPP=   -2.169392E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6841 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6842 EBE=      -3.746949E+01 WEIGHT=    1.138730D+00 (bending)
6843 ESC=       4.032019E+01 WEIGHT=    1.625800D-01 (SC local)
6844 ETORS=     8.412692E+00 WEIGHT=    1.985990D+00 (torsional)
6845 ETORSD=    1.082782E+00 WEIGHT=    1.570690D+00 (double torsional)
6846 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6847 ECORR4=   -5.910419E+01 WEIGHT=    4.288700D-01 (multi-body)
6848 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6849 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6850 EELLO=    -2.150570E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6851 ETURN3=    1.567797E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6852 ETURN4=   -2.506688E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6853 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6854 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6855 EDIHC=     0.000000E+00 (dihedral angle constraints)
6856 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6857 UCONST=     0.000000E+00 (Constraint energy)
6858 EDFAD=     5.491269-315 (DFA distance energy)
6859 EDFAT=     6.953158-310 (DFA torsion energy)
6860 EDFAN=     6.953158-310 (DFA NCa energy)
6861 EDFAB=     2.650815-317 (DFA Beta energy)
6862 ETOT=     -8.408609E+01 (total)
6863 RMS deviation from the reference structure:   3.110
6864  % of native contacts:  33.333
6865  % of nonnative contacts:  76.471
6866  contact order:   0.299
6867  TM-score with the reference structure:     0.32
6868  Conformation #         181  read
6869
6870
6871  Conformation #         180  sumsl return code            4
6872
6873 Virtual-chain energies:
6874
6875 EVDW=     -5.294898E+01 WEIGHT=    1.352790D+00 (SC-SC)
6876 EVDW2=     4.812379E+01 WEIGHT=    1.593040D+00 (SC-p)
6877 EES=      -9.213610E+01 WEIGHT=    7.153400D-01 (p-p)
6878 EVDWPP=   -2.157037E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6879 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6880 EBE=      -3.855572E+01 WEIGHT=    1.138730D+00 (bending)
6881 ESC=       3.654539E+01 WEIGHT=    1.625800D-01 (SC local)
6882 ETORS=     8.779046E+00 WEIGHT=    1.985990D+00 (torsional)
6883 ETORSD=   -1.219924E+00 WEIGHT=    1.570690D+00 (double torsional)
6884 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6885 ECORR4=   -6.978885E+01 WEIGHT=    4.288700D-01 (multi-body)
6886 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6887 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6888 EELLO=    -4.539127E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6889 ETURN3=    1.824649E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6890 ETURN4=   -2.513995E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6891 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6892 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6893 EDIHC=     0.000000E+00 (dihedral angle constraints)
6894 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6895 UCONST=     0.000000E+00 (Constraint energy)
6896 EDFAD=     5.491269-315 (DFA distance energy)
6897 EDFAT=     6.953158-310 (DFA torsion energy)
6898 EDFAN=     6.953158-310 (DFA NCa energy)
6899 EDFAB=     2.650815-317 (DFA Beta energy)
6900 ETOT=     -8.730857E+01 (total)
6901 RMS deviation from the reference structure:   6.420
6902  % of native contacts:  16.667
6903  % of nonnative contacts:  89.474
6904  contact order:   0.242
6905  TM-score with the reference structure:     0.29
6906  Conformation #         182  read
6907
6908
6909  Conformation #         181  sumsl return code            4
6910
6911 Virtual-chain energies:
6912
6913 EVDW=     -5.167435E+01 WEIGHT=    1.352790D+00 (SC-SC)
6914 EVDW2=     5.104408E+01 WEIGHT=    1.593040D+00 (SC-p)
6915 EES=      -1.084604E+02 WEIGHT=    7.153400D-01 (p-p)
6916 EVDWPP=   -2.602434E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6917 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6918 EBE=      -3.813912E+01 WEIGHT=    1.138730D+00 (bending)
6919 ESC=       4.983673E+01 WEIGHT=    1.625800D-01 (SC local)
6920 ETORS=     1.253011E+01 WEIGHT=    1.985990D+00 (torsional)
6921 ETORSD=   -2.084882E+00 WEIGHT=    1.570690D+00 (double torsional)
6922 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6923 ECORR4=   -8.355082E+01 WEIGHT=    4.288700D-01 (multi-body)
6924 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6925 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6926 EELLO=    -2.786102E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
6927 ETURN3=    2.099811E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6928 ETURN4=   -2.656303E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6929 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6930 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6931 EDIHC=     0.000000E+00 (dihedral angle constraints)
6932 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6933 UCONST=     0.000000E+00 (Constraint energy)
6934 EDFAD=     5.491269-315 (DFA distance energy)
6935 EDFAT=     6.953158-310 (DFA torsion energy)
6936 EDFAN=     6.953158-310 (DFA NCa energy)
6937 EDFAB=     2.650815-317 (DFA Beta energy)
6938 ETOT=     -8.506024E+01 (total)
6939 RMS deviation from the reference structure:   3.374
6940  % of native contacts:  33.333
6941  % of nonnative contacts:  78.947
6942  contact order:   0.189
6943  TM-score with the reference structure:     0.28
6944  Conformation #         183  read
6945
6946
6947  Conformation #         179  sumsl return code            4
6948
6949 Virtual-chain energies:
6950
6951 EVDW=     -5.042455E+01 WEIGHT=    1.352790D+00 (SC-SC)
6952 EVDW2=     5.031530E+01 WEIGHT=    1.593040D+00 (SC-p)
6953 EES=      -9.977404E+01 WEIGHT=    7.153400D-01 (p-p)
6954 EVDWPP=   -3.150805E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6955 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6956 EBE=      -4.137169E+01 WEIGHT=    1.138730D+00 (bending)
6957 ESC=       4.365129E+01 WEIGHT=    1.625800D-01 (SC local)
6958 ETORS=     9.826279E+00 WEIGHT=    1.985990D+00 (torsional)
6959 ETORSD=    1.139928E+00 WEIGHT=    1.570690D+00 (double torsional)
6960 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6961 ECORR4=   -7.122898E+01 WEIGHT=    4.288700D-01 (multi-body)
6962 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6963 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
6964 EELLO=    -2.375760E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
6965 ETURN3=    1.812851E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
6966 ETURN4=   -3.968888E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
6967 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
6968 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
6969 EDIHC=     0.000000E+00 (dihedral angle constraints)
6970 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
6971 UCONST=     0.000000E+00 (Constraint energy)
6972 EDFAD=     5.491269-315 (DFA distance energy)
6973 EDFAT=     6.953158-310 (DFA torsion energy)
6974 EDFAN=     6.953158-310 (DFA NCa energy)
6975 EDFAB=     2.650815-317 (DFA Beta energy)
6976 ETOT=     -8.469444E+01 (total)
6977 RMS deviation from the reference structure:   3.290
6978  % of native contacts:  41.667
6979  % of nonnative contacts:  75.000
6980  contact order:   0.327
6981  TM-score with the reference structure:     0.28
6982  Conformation #         184  read
6983
6984
6985  Conformation #         183  sumsl return code            4
6986
6987 Virtual-chain energies:
6988
6989 EVDW=     -5.290662E+01 WEIGHT=    1.352790D+00 (SC-SC)
6990 EVDW2=     5.203538E+01 WEIGHT=    1.593040D+00 (SC-p)
6991 EES=      -1.058172E+02 WEIGHT=    7.153400D-01 (p-p)
6992 EVDWPP=   -1.801298E+01 WEIGHT=    1.137100D-01 (p-p VDW)
6993 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
6994 EBE=      -4.072206E+01 WEIGHT=    1.138730D+00 (bending)
6995 ESC=       4.100340E+01 WEIGHT=    1.625800D-01 (SC local)
6996 ETORS=     1.109474E+01 WEIGHT=    1.985990D+00 (torsional)
6997 ETORSD=   -6.266683E-01 WEIGHT=    1.570690D+00 (double torsional)
6998 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
6999 ECORR4=   -7.995712E+01 WEIGHT=    4.288700D-01 (multi-body)
7000 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7001 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7002 EELLO=    -6.493522E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7003 ETURN3=    1.980893E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7004 ETURN4=   -9.313854E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7005 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7006 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7007 EDIHC=     0.000000E+00 (dihedral angle constraints)
7008 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7009 UCONST=     0.000000E+00 (Constraint energy)
7010 EDFAD=     5.491269-315 (DFA distance energy)
7011 EDFAT=     6.953158-310 (DFA torsion energy)
7012 EDFAN=     6.953158-310 (DFA NCa energy)
7013 EDFAB=     2.650815-317 (DFA Beta energy)
7014 ETOT=     -8.760333E+01 (total)
7015 RMS deviation from the reference structure:   2.398
7016  % of native contacts:  66.667
7017  % of nonnative contacts:  61.905
7018  contact order:   0.281
7019  TM-score with the reference structure:     0.33
7020  Conformation #         185  read
7021
7022
7023  Conformation #         182  sumsl return code            4
7024
7025 Virtual-chain energies:
7026
7027 EVDW=     -5.183758E+01 WEIGHT=    1.352790D+00 (SC-SC)
7028 EVDW2=     4.743454E+01 WEIGHT=    1.593040D+00 (SC-p)
7029 EES=      -9.154283E+01 WEIGHT=    7.153400D-01 (p-p)
7030 EVDWPP=   -2.167486E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7031 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7032 EBE=      -3.499176E+01 WEIGHT=    1.138730D+00 (bending)
7033 ESC=       3.142609E+01 WEIGHT=    1.625800D-01 (SC local)
7034 ETORS=     1.130860E+01 WEIGHT=    1.985990D+00 (torsional)
7035 ETORSD=   -3.803475E+00 WEIGHT=    1.570690D+00 (double torsional)
7036 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7037 ECORR4=   -6.666148E+01 WEIGHT=    4.288700D-01 (multi-body)
7038 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7039 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7040 EELLO=    -4.392275E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7041 ETURN3=    1.499051E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7042 ETURN4=   -4.417870E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7043 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7044 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7045 EDIHC=     0.000000E+00 (dihedral angle constraints)
7046 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7047 UCONST=     0.000000E+00 (Constraint energy)
7048 EDFAD=     5.491269-315 (DFA distance energy)
7049 EDFAT=     6.953158-310 (DFA torsion energy)
7050 EDFAN=     6.953158-310 (DFA NCa energy)
7051 EDFAB=     2.650815-317 (DFA Beta energy)
7052 ETOT=     -8.505513E+01 (total)
7053 RMS deviation from the reference structure:   4.486
7054  % of native contacts:  33.333
7055  % of nonnative contacts:  80.952
7056  contact order:   0.335
7057  TM-score with the reference structure:     0.30
7058  Conformation #         186  read
7059
7060
7061  Conformation #         177  sumsl return code            4
7062
7063 Virtual-chain energies:
7064
7065 EVDW=     -5.660066E+01 WEIGHT=    1.352790D+00 (SC-SC)
7066 EVDW2=     5.442083E+01 WEIGHT=    1.593040D+00 (SC-p)
7067 EES=      -1.058948E+02 WEIGHT=    7.153400D-01 (p-p)
7068 EVDWPP=   -3.205653E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7069 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7070 EBE=      -3.555007E+01 WEIGHT=    1.138730D+00 (bending)
7071 ESC=       5.102221E+01 WEIGHT=    1.625800D-01 (SC local)
7072 ETORS=     1.252794E+01 WEIGHT=    1.985990D+00 (torsional)
7073 ETORSD=   -2.967661E+00 WEIGHT=    1.570690D+00 (double torsional)
7074 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7075 ECORR4=   -8.298172E+01 WEIGHT=    4.288700D-01 (multi-body)
7076 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7077 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7078 EELLO=    -8.454496E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7079 ETURN3=    1.902086E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7080 ETURN4=    2.614676E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7081 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7082 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7083 EDIHC=     0.000000E+00 (dihedral angle constraints)
7084 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7085 UCONST=     0.000000E+00 (Constraint energy)
7086 EDFAD=     5.491269-315 (DFA distance energy)
7087 EDFAT=     6.953158-310 (DFA torsion energy)
7088 EDFAN=     6.953158-310 (DFA NCa energy)
7089 EDFAB=     2.650815-317 (DFA Beta energy)
7090 ETOT=     -8.435787E+01 (total)
7091 RMS deviation from the reference structure:   2.834
7092  % of native contacts:  41.667
7093  % of nonnative contacts:  79.167
7094  contact order:   0.343
7095  TM-score with the reference structure:     0.33
7096  Conformation #         187  read
7097
7098
7099  Conformation #         185  sumsl return code            4
7100
7101 Virtual-chain energies:
7102
7103 EVDW=     -5.122106E+01 WEIGHT=    1.352790D+00 (SC-SC)
7104 EVDW2=     4.786912E+01 WEIGHT=    1.593040D+00 (SC-p)
7105 EES=      -1.002588E+02 WEIGHT=    7.153400D-01 (p-p)
7106 EVDWPP=   -2.521081E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7107 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7108 EBE=      -4.291917E+01 WEIGHT=    1.138730D+00 (bending)
7109 ESC=       3.728613E+01 WEIGHT=    1.625800D-01 (SC local)
7110 ETORS=     1.028393E+01 WEIGHT=    1.985990D+00 (torsional)
7111 ETORSD=    3.914362E+00 WEIGHT=    1.570690D+00 (double torsional)
7112 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7113 ECORR4=   -6.994705E+01 WEIGHT=    4.288700D-01 (multi-body)
7114 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7115 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7116 EELLO=    -4.417315E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7117 ETURN3=    1.652343E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7118 ETURN4=   -5.623878E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7119 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7120 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7121 EDIHC=     0.000000E+00 (dihedral angle constraints)
7122 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7123 UCONST=     0.000000E+00 (Constraint energy)
7124 EDFAD=     5.491269-315 (DFA distance energy)
7125 EDFAT=     6.953158-310 (DFA torsion energy)
7126 EDFAN=     6.953158-310 (DFA NCa energy)
7127 EDFAB=     2.650815-317 (DFA Beta energy)
7128 ETOT=     -8.705950E+01 (total)
7129 RMS deviation from the reference structure:   3.761
7130  % of native contacts:  41.667
7131  % of nonnative contacts:  75.000
7132  contact order:   0.307
7133  TM-score with the reference structure:     0.28
7134  Conformation #         188  read
7135
7136
7137  Conformation #         184  sumsl return code            4
7138
7139 Virtual-chain energies:
7140
7141 EVDW=     -5.318955E+01 WEIGHT=    1.352790D+00 (SC-SC)
7142 EVDW2=     4.969906E+01 WEIGHT=    1.593040D+00 (SC-p)
7143 EES=      -1.045343E+02 WEIGHT=    7.153400D-01 (p-p)
7144 EVDWPP=   -1.798253E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7145 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7146 EBE=      -4.003468E+01 WEIGHT=    1.138730D+00 (bending)
7147 ESC=       3.676988E+01 WEIGHT=    1.625800D-01 (SC local)
7148 ETORS=     1.251207E+01 WEIGHT=    1.985990D+00 (torsional)
7149 ETORSD=   -2.680267E+00 WEIGHT=    1.570690D+00 (double torsional)
7150 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7151 ECORR4=   -7.570196E+01 WEIGHT=    4.288700D-01 (multi-body)
7152 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7153 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7154 EELLO=     7.288080E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7155 ETURN3=    1.891175E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7156 ETURN4=   -1.776835E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7157 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7158 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7159 EDIHC=     0.000000E+00 (dihedral angle constraints)
7160 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7161 UCONST=     0.000000E+00 (Constraint energy)
7162 EDFAD=     5.491269-315 (DFA distance energy)
7163 EDFAT=     6.953158-310 (DFA torsion energy)
7164 EDFAN=     6.953158-310 (DFA NCa energy)
7165 EDFAB=     2.650815-317 (DFA Beta energy)
7166 ETOT=     -9.019365E+01 (total)
7167 RMS deviation from the reference structure:   3.728
7168  % of native contacts:  33.333
7169  % of nonnative contacts:  81.818
7170  contact order:   0.374
7171  TM-score with the reference structure:     0.28
7172  Conformation #         189  read
7173
7174
7175  Conformation #         166  sumsl return code            4
7176
7177 Virtual-chain energies:
7178
7179 EVDW=     -5.333903E+01 WEIGHT=    1.352790D+00 (SC-SC)
7180 EVDW2=     4.213416E+01 WEIGHT=    1.593040D+00 (SC-p)
7181 EES=      -7.904729E+01 WEIGHT=    7.153400D-01 (p-p)
7182 EVDWPP=   -2.512922E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7183 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7184 EBE=      -3.651884E+01 WEIGHT=    1.138730D+00 (bending)
7185 ESC=       4.160977E+01 WEIGHT=    1.625800D-01 (SC local)
7186 ETORS=     7.266246E+00 WEIGHT=    1.985990D+00 (torsional)
7187 ETORSD=   -1.867551E-01 WEIGHT=    1.570690D+00 (double torsional)
7188 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7189 ECORR4=   -6.037951E+01 WEIGHT=    4.288700D-01 (multi-body)
7190 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7191 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7192 EELLO=    -2.210958E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7193 ETURN3=    1.594324E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7194 ETURN4=   -1.698871E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7195 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7196 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7197 EDIHC=     0.000000E+00 (dihedral angle constraints)
7198 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7199 UCONST=     0.000000E+00 (Constraint energy)
7200 EDFAD=     5.491269-315 (DFA distance energy)
7201 EDFAT=     6.953158-310 (DFA torsion energy)
7202 EDFAN=     6.953158-310 (DFA NCa energy)
7203 EDFAB=     2.650815-317 (DFA Beta energy)
7204 ETOT=     -8.559597E+01 (total)
7205 RMS deviation from the reference structure:   3.749
7206  % of native contacts:  41.667
7207  % of nonnative contacts:  76.190
7208  contact order:   0.310
7209  TM-score with the reference structure:     0.28
7210  Conformation #         190  read
7211
7212
7213  Conformation #         188  sumsl return code            4
7214
7215 Virtual-chain energies:
7216
7217 EVDW=     -5.396331E+01 WEIGHT=    1.352790D+00 (SC-SC)
7218 EVDW2=     3.559336E+01 WEIGHT=    1.593040D+00 (SC-p)
7219 EES=      -6.291128E+01 WEIGHT=    7.153400D-01 (p-p)
7220 EVDWPP=   -2.748976E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7221 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7222 EBE=      -3.846170E+01 WEIGHT=    1.138730D+00 (bending)
7223 ESC=       4.909058E+01 WEIGHT=    1.625800D-01 (SC local)
7224 ETORS=     6.041010E+00 WEIGHT=    1.985990D+00 (torsional)
7225 ETORSD=    6.821197E-01 WEIGHT=    1.570690D+00 (double torsional)
7226 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7227 ECORR4=   -4.213342E+01 WEIGHT=    4.288700D-01 (multi-body)
7228 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7229 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7230 EELLO=    -3.740863E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7231 ETURN3=    1.339574E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7232 ETURN4=   -2.117864E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7233 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7234 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7235 EDIHC=     0.000000E+00 (dihedral angle constraints)
7236 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7237 UCONST=     0.000000E+00 (Constraint energy)
7238 EDFAD=     5.491269-315 (DFA distance energy)
7239 EDFAT=     6.953158-310 (DFA torsion energy)
7240 EDFAN=     6.953158-310 (DFA NCa energy)
7241 EDFAB=     2.650815-317 (DFA Beta energy)
7242 ETOT=     -8.410660E+01 (total)
7243 RMS deviation from the reference structure:   5.616
7244  % of native contacts:  16.667
7245  % of nonnative contacts:  87.500
7246  contact order:   0.355
7247  TM-score with the reference structure:     0.24
7248  Conformation #         191  read
7249
7250
7251  Conformation #         189  sumsl return code            4
7252
7253 Virtual-chain energies:
7254
7255 EVDW=     -5.263079E+01 WEIGHT=    1.352790D+00 (SC-SC)
7256 EVDW2=     5.408111E+01 WEIGHT=    1.593040D+00 (SC-p)
7257 EES=      -1.113443E+02 WEIGHT=    7.153400D-01 (p-p)
7258 EVDWPP=   -2.325035E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7259 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7260 EBE=      -4.095656E+01 WEIGHT=    1.138730D+00 (bending)
7261 ESC=       4.467374E+01 WEIGHT=    1.625800D-01 (SC local)
7262 ETORS=     1.263673E+01 WEIGHT=    1.985990D+00 (torsional)
7263 ETORSD=   -1.837568E+00 WEIGHT=    1.570690D+00 (double torsional)
7264 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7265 ECORR4=   -8.539620E+01 WEIGHT=    4.288700D-01 (multi-body)
7266 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7267 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7268 EELLO=    -2.807585E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7269 ETURN3=    2.011414E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7270 ETURN4=   -5.824715E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7271 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7272 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7273 EDIHC=     0.000000E+00 (dihedral angle constraints)
7274 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7275 UCONST=     0.000000E+00 (Constraint energy)
7276 EDFAD=     5.491269-315 (DFA distance energy)
7277 EDFAT=     6.953158-310 (DFA torsion energy)
7278 EDFAN=     6.953158-310 (DFA NCa energy)
7279 EDFAB=     2.650815-317 (DFA Beta energy)
7280 ETOT=     -8.802600E+01 (total)
7281 RMS deviation from the reference structure:   2.436
7282  % of native contacts:  58.333
7283  % of nonnative contacts:  61.111
7284  contact order:   0.308
7285  TM-score with the reference structure:     0.29
7286  Conformation #         192  read
7287
7288
7289  Conformation #         191  sumsl return code            4
7290
7291 Virtual-chain energies:
7292
7293 EVDW=     -5.073871E+01 WEIGHT=    1.352790D+00 (SC-SC)
7294 EVDW2=     4.056598E+01 WEIGHT=    1.593040D+00 (SC-p)
7295 EES=      -8.352356E+01 WEIGHT=    7.153400D-01 (p-p)
7296 EVDWPP=   -1.918988E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7297 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7298 EBE=      -3.957057E+01 WEIGHT=    1.138730D+00 (bending)
7299 ESC=       4.761702E+01 WEIGHT=    1.625800D-01 (SC local)
7300 ETORS=     1.000853E+01 WEIGHT=    1.985990D+00 (torsional)
7301 ETORSD=   -1.546632E+00 WEIGHT=    1.570690D+00 (double torsional)
7302 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7303 ECORR4=   -6.250790E+01 WEIGHT=    4.288700D-01 (multi-body)
7304 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7305 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7306 EELLO=     2.737265E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7307 ETURN3=    1.727535E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7308 ETURN4=   -2.546896E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7309 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7310 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7311 EDIHC=     0.000000E+00 (dihedral angle constraints)
7312 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7313 UCONST=     0.000000E+00 (Constraint energy)
7314 EDFAD=     5.491269-315 (DFA distance energy)
7315 EDFAT=     6.953158-310 (DFA torsion energy)
7316 EDFAN=     6.953158-310 (DFA NCa energy)
7317 EDFAB=     2.650815-317 (DFA Beta energy)
7318 ETOT=     -8.472478E+01 (total)
7319 RMS deviation from the reference structure:   5.554
7320  % of native contacts:  25.000
7321  % of nonnative contacts:  85.000
7322  contact order:   0.316
7323  TM-score with the reference structure:     0.31
7324  Conformation #         193  read
7325
7326
7327  Conformation #         186  sumsl return code            4
7328
7329 Virtual-chain energies:
7330
7331 EVDW=     -5.527879E+01 WEIGHT=    1.352790D+00 (SC-SC)
7332 EVDW2=     4.375751E+01 WEIGHT=    1.593040D+00 (SC-p)
7333 EES=      -7.807597E+01 WEIGHT=    7.153400D-01 (p-p)
7334 EVDWPP=   -3.103049E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7335 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7336 EBE=      -3.585945E+01 WEIGHT=    1.138730D+00 (bending)
7337 ESC=       4.123252E+01 WEIGHT=    1.625800D-01 (SC local)
7338 ETORS=     9.267809E+00 WEIGHT=    1.985990D+00 (torsional)
7339 ETORSD=   -2.792440E+00 WEIGHT=    1.570690D+00 (double torsional)
7340 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7341 ECORR4=   -5.844763E+01 WEIGHT=    4.288700D-01 (multi-body)
7342 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7343 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7344 EELLO=     2.758348E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7345 ETURN3=    1.485649E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7346 ETURN4=    6.428202E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7347 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7348 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7349 EDIHC=     0.000000E+00 (dihedral angle constraints)
7350 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7351 UCONST=     0.000000E+00 (Constraint energy)
7352 EDFAD=     5.491269-315 (DFA distance energy)
7353 EDFAT=     6.953158-310 (DFA torsion energy)
7354 EDFAN=     6.953158-310 (DFA NCa energy)
7355 EDFAB=     2.650815-317 (DFA Beta energy)
7356 ETOT=     -8.409368E+01 (total)
7357 RMS deviation from the reference structure:   5.093
7358  % of native contacts:  25.000
7359  % of nonnative contacts:  86.364
7360  contact order:   0.357
7361  TM-score with the reference structure:     0.28
7362  Conformation #         194  read
7363
7364
7365  Conformation #         187  sumsl return code            4
7366
7367 Virtual-chain energies:
7368
7369 EVDW=     -5.088940E+01 WEIGHT=    1.352790D+00 (SC-SC)
7370 EVDW2=     4.624359E+01 WEIGHT=    1.593040D+00 (SC-p)
7371 EES=      -9.557901E+01 WEIGHT=    7.153400D-01 (p-p)
7372 EVDWPP=   -2.950596E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7373 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7374 EBE=      -3.688642E+01 WEIGHT=    1.138730D+00 (bending)
7375 ESC=       4.134814E+01 WEIGHT=    1.625800D-01 (SC local)
7376 ETORS=     8.929300E+00 WEIGHT=    1.985990D+00 (torsional)
7377 ETORSD=    2.340901E+00 WEIGHT=    1.570690D+00 (double torsional)
7378 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7379 ECORR4=   -7.151629E+01 WEIGHT=    4.288700D-01 (multi-body)
7380 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7381 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7382 EELLO=    -5.369463E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7383 ETURN3=    1.836256E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7384 ETURN4=   -5.442761E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7385 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7386 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7387 EDIHC=     0.000000E+00 (dihedral angle constraints)
7388 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7389 UCONST=     0.000000E+00 (Constraint energy)
7390 EDFAD=     5.491269-315 (DFA distance energy)
7391 EDFAT=     6.953158-310 (DFA torsion energy)
7392 EDFAN=     6.953158-310 (DFA NCa energy)
7393 EDFAB=     2.650815-317 (DFA Beta energy)
7394 ETOT=     -8.492766E+01 (total)
7395 RMS deviation from the reference structure:   2.237
7396  % of native contacts:  41.667
7397  % of nonnative contacts:  75.000
7398  contact order:   0.336
7399  TM-score with the reference structure:     0.37
7400  Conformation #         195  read
7401
7402
7403  Conformation #         193  sumsl return code            4
7404
7405 Virtual-chain energies:
7406
7407 EVDW=     -5.549345E+01 WEIGHT=    1.352790D+00 (SC-SC)
7408 EVDW2=     4.532214E+01 WEIGHT=    1.593040D+00 (SC-p)
7409 EES=      -8.233249E+01 WEIGHT=    7.153400D-01 (p-p)
7410 EVDWPP=   -3.144804E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7411 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7412 EBE=      -3.501135E+01 WEIGHT=    1.138730D+00 (bending)
7413 ESC=       4.260462E+01 WEIGHT=    1.625800D-01 (SC local)
7414 ETORS=     5.996061E+00 WEIGHT=    1.985990D+00 (torsional)
7415 ETORSD=    1.862324E-01 WEIGHT=    1.570690D+00 (double torsional)
7416 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7417 ECORR4=   -6.112928E+01 WEIGHT=    4.288700D-01 (multi-body)
7418 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7419 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7420 EELLO=    -2.678970E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7421 ETURN3=    1.476247E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7422 ETURN4=   -1.490979E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7423 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7424 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7425 EDIHC=     0.000000E+00 (dihedral angle constraints)
7426 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7427 UCONST=     0.000000E+00 (Constraint energy)
7428 EDFAD=     5.491269-315 (DFA distance energy)
7429 EDFAT=     6.953158-310 (DFA torsion energy)
7430 EDFAN=     6.953158-310 (DFA NCa energy)
7431 EDFAB=     2.650815-317 (DFA Beta energy)
7432 ETOT=     -8.792121E+01 (total)
7433 RMS deviation from the reference structure:   3.379
7434  % of native contacts:  58.333
7435  % of nonnative contacts:  65.000
7436  contact order:   0.307
7437  TM-score with the reference structure:     0.30
7438  Conformation #         196  read
7439
7440
7441  Conformation #         194  sumsl return code            4
7442
7443 Virtual-chain energies:
7444
7445 EVDW=     -5.151012E+01 WEIGHT=    1.352790D+00 (SC-SC)
7446 EVDW2=     4.463204E+01 WEIGHT=    1.593040D+00 (SC-p)
7447 EES=      -9.106776E+01 WEIGHT=    7.153400D-01 (p-p)
7448 EVDWPP=   -1.006752E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7449 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7450 EBE=      -3.875413E+01 WEIGHT=    1.138730D+00 (bending)
7451 ESC=       3.400160E+01 WEIGHT=    1.625800D-01 (SC local)
7452 ETORS=     1.056549E+01 WEIGHT=    1.985990D+00 (torsional)
7453 ETORSD=   -1.360475E+00 WEIGHT=    1.570690D+00 (double torsional)
7454 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7455 ECORR4=   -6.774039E+01 WEIGHT=    4.288700D-01 (multi-body)
7456 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7457 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7458 EELLO=     4.233215E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7459 ETURN3=    1.831070E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7460 ETURN4=   -2.527068E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7461 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7462 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7463 EDIHC=     0.000000E+00 (dihedral angle constraints)
7464 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7465 UCONST=     0.000000E+00 (Constraint energy)
7466 EDFAD=     5.491269-315 (DFA distance energy)
7467 EDFAT=     6.953158-310 (DFA torsion energy)
7468 EDFAN=     6.953158-310 (DFA NCa energy)
7469 EDFAB=     2.650815-317 (DFA Beta energy)
7470 ETOT=     -8.439082E+01 (total)
7471 RMS deviation from the reference structure:   4.765
7472  % of native contacts:  25.000
7473  % of nonnative contacts:  84.211
7474  contact order:   0.378
7475  TM-score with the reference structure:     0.26
7476  Conformation #         197  read
7477
7478
7479  Conformation #         195  sumsl return code            4
7480
7481 Virtual-chain energies:
7482
7483 EVDW=     -5.188865E+01 WEIGHT=    1.352790D+00 (SC-SC)
7484 EVDW2=     3.830600E+01 WEIGHT=    1.593040D+00 (SC-p)
7485 EES=      -6.851159E+01 WEIGHT=    7.153400D-01 (p-p)
7486 EVDWPP=   -3.174164E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7487 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7488 EBE=      -3.934667E+01 WEIGHT=    1.138730D+00 (bending)
7489 ESC=       3.572007E+01 WEIGHT=    1.625800D-01 (SC local)
7490 ETORS=     8.744843E+00 WEIGHT=    1.985990D+00 (torsional)
7491 ETORSD=   -2.421162E+00 WEIGHT=    1.570690D+00 (double torsional)
7492 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7493 ECORR4=   -5.113101E+01 WEIGHT=    4.288700D-01 (multi-body)
7494 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7495 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7496 EELLO=     4.052227E-02 WEIGHT=    1.603600D-01 (electrostatic-local)
7497 ETURN3=    1.391149E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7498 ETURN4=   -1.065063E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7499 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7500 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7501 EDIHC=     0.000000E+00 (dihedral angle constraints)
7502 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7503 UCONST=     0.000000E+00 (Constraint energy)
7504 EDFAD=     5.491269-315 (DFA distance energy)
7505 EDFAT=     6.953158-310 (DFA torsion energy)
7506 EDFAN=     6.953158-310 (DFA NCa energy)
7507 EDFAB=     2.650815-317 (DFA Beta energy)
7508 ETOT=     -8.637917E+01 (total)
7509 RMS deviation from the reference structure:   4.817
7510  % of native contacts:  16.667
7511  % of nonnative contacts:  90.476
7512  contact order:   0.407
7513  TM-score with the reference structure:     0.32
7514  Conformation #         198  read
7515
7516
7517  Conformation #         196  sumsl return code            4
7518
7519 Virtual-chain energies:
7520
7521 EVDW=     -5.689562E+01 WEIGHT=    1.352790D+00 (SC-SC)
7522 EVDW2=     3.953417E+01 WEIGHT=    1.593040D+00 (SC-p)
7523 EES=      -6.575149E+01 WEIGHT=    7.153400D-01 (p-p)
7524 EVDWPP=   -3.242620E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7525 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7526 EBE=      -3.655341E+01 WEIGHT=    1.138730D+00 (bending)
7527 ESC=       4.668342E+01 WEIGHT=    1.625800D-01 (SC local)
7528 ETORS=     5.437181E+00 WEIGHT=    1.985990D+00 (torsional)
7529 ETORSD=    1.050091E-02 WEIGHT=    1.570690D+00 (double torsional)
7530 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7531 ECORR4=   -5.033938E+01 WEIGHT=    4.288700D-01 (multi-body)
7532 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7533 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7534 EELLO=     6.645582E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7535 ETURN3=    1.246771E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7536 ETURN4=   -7.467353E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7537 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7538 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7539 EDIHC=     0.000000E+00 (dihedral angle constraints)
7540 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7541 UCONST=     0.000000E+00 (Constraint energy)
7542 EDFAD=     5.491269-315 (DFA distance energy)
7543 EDFAT=     6.953158-310 (DFA torsion energy)
7544 EDFAN=     6.953158-310 (DFA NCa energy)
7545 EDFAB=     2.650815-317 (DFA Beta energy)
7546 ETOT=     -8.887143E+01 (total)
7547 RMS deviation from the reference structure:   4.090
7548  % of native contacts:  41.667
7549  % of nonnative contacts:  77.273
7550  contact order:   0.430
7551  TM-score with the reference structure:     0.23
7552  Conformation #         199  read
7553
7554
7555  Conformation #         198  sumsl return code            4
7556
7557 Virtual-chain energies:
7558
7559 EVDW=     -5.176116E+01 WEIGHT=    1.352790D+00 (SC-SC)
7560 EVDW2=     3.918403E+01 WEIGHT=    1.593040D+00 (SC-p)
7561 EES=      -7.508124E+01 WEIGHT=    7.153400D-01 (p-p)
7562 EVDWPP=   -1.767172E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7563 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7564 EBE=      -3.849045E+01 WEIGHT=    1.138730D+00 (bending)
7565 ESC=       4.386108E+01 WEIGHT=    1.625800D-01 (SC local)
7566 ETORS=     8.613555E+00 WEIGHT=    1.985990D+00 (torsional)
7567 ETORSD=   -1.102559E+00 WEIGHT=    1.570690D+00 (double torsional)
7568 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7569 ECORR4=   -5.446175E+01 WEIGHT=    4.288700D-01 (multi-body)
7570 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7571 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7572 EELLO=     2.582089E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7573 ETURN3=    1.431340E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7574 ETURN4=   -3.237543E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7575 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7576 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7577 EDIHC=     0.000000E+00 (dihedral angle constraints)
7578 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7579 UCONST=     0.000000E+00 (Constraint energy)
7580 EDFAD=     5.491269-315 (DFA distance energy)
7581 EDFAT=     6.953158-310 (DFA torsion energy)
7582 EDFAN=     6.953158-310 (DFA NCa energy)
7583 EDFAB=     2.650815-317 (DFA Beta energy)
7584 ETOT=     -8.558028E+01 (total)
7585 RMS deviation from the reference structure:   4.677
7586  % of native contacts:  25.000
7587  % of nonnative contacts:  82.353
7588  contact order:   0.447
7589  TM-score with the reference structure:     0.29
7590  Conformation #         200  read
7591
7592
7593  Conformation #         192  sumsl return code            4
7594
7595 Virtual-chain energies:
7596
7597 EVDW=     -5.120452E+01 WEIGHT=    1.352790D+00 (SC-SC)
7598 EVDW2=     4.128917E+01 WEIGHT=    1.593040D+00 (SC-p)
7599 EES=      -8.326864E+01 WEIGHT=    7.153400D-01 (p-p)
7600 EVDWPP=   -1.767216E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7601 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7602 EBE=      -4.027511E+01 WEIGHT=    1.138730D+00 (bending)
7603 ESC=       4.642033E+01 WEIGHT=    1.625800D-01 (SC local)
7604 ETORS=     9.392966E+00 WEIGHT=    1.985990D+00 (torsional)
7605 ETORSD=   -1.988926E+00 WEIGHT=    1.570690D+00 (double torsional)
7606 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7607 ECORR4=   -6.319091E+01 WEIGHT=    4.288700D-01 (multi-body)
7608 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7609 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7610 EELLO=    -9.628265E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7611 ETURN3=    1.739036E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7612 ETURN4=   -1.959788E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7613 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7614 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7615 EDIHC=     0.000000E+00 (dihedral angle constraints)
7616 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7617 UCONST=     0.000000E+00 (Constraint energy)
7618 EDFAD=     5.491269-315 (DFA distance energy)
7619 EDFAT=     6.953158-310 (DFA torsion energy)
7620 EDFAN=     6.953158-310 (DFA NCa energy)
7621 EDFAB=     2.650815-317 (DFA Beta energy)
7622 ETOT=     -8.706537E+01 (total)
7623 RMS deviation from the reference structure:   5.028
7624  % of native contacts:  50.000
7625  % of nonnative contacts:  70.000
7626  contact order:   0.282
7627  TM-score with the reference structure:     0.33
7628
7629
7630  Conformation #         200  sumsl return code            4
7631
7632 Virtual-chain energies:
7633
7634 EVDW=     -5.424967E+01 WEIGHT=    1.352790D+00 (SC-SC)
7635 EVDW2=     3.739725E+01 WEIGHT=    1.593040D+00 (SC-p)
7636 EES=      -6.507971E+01 WEIGHT=    7.153400D-01 (p-p)
7637 EVDWPP=   -2.899902E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7638 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7639 EBE=      -3.664801E+01 WEIGHT=    1.138730D+00 (bending)
7640 ESC=       3.556747E+01 WEIGHT=    1.625800D-01 (SC local)
7641 ETORS=     5.566837E+00 WEIGHT=    1.985990D+00 (torsional)
7642 ETORSD=   -9.866388E-01 WEIGHT=    1.570690D+00 (double torsional)
7643 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7644 ECORR4=   -4.817315E+01 WEIGHT=    4.288700D-01 (multi-body)
7645 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7646 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7647 EELLO=    -2.342387E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7648 ETURN3=    1.437203E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7649 ETURN4=   -1.758924E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7650 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7651 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7652 EDIHC=     0.000000E+00 (dihedral angle constraints)
7653 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7654 UCONST=     0.000000E+00 (Constraint energy)
7655 EDFAD=     5.491269-315 (DFA distance energy)
7656 EDFAT=     6.953158-310 (DFA torsion energy)
7657 EDFAN=     6.953158-310 (DFA NCa energy)
7658 EDFAB=     2.650815-317 (DFA Beta energy)
7659 ETOT=     -8.806015E+01 (total)
7660 RMS deviation from the reference structure:   4.376
7661  % of native contacts:  41.667
7662  % of nonnative contacts:  78.261
7663  contact order:   0.387
7664  TM-score with the reference structure:     0.28
7665
7666
7667  Conformation #         199  sumsl return code            4
7668
7669 Virtual-chain energies:
7670
7671 EVDW=     -5.087801E+01 WEIGHT=    1.352790D+00 (SC-SC)
7672 EVDW2=     4.564249E+01 WEIGHT=    1.593040D+00 (SC-p)
7673 EES=      -8.564950E+01 WEIGHT=    7.153400D-01 (p-p)
7674 EVDWPP=   -2.233310E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7675 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7676 EBE=      -3.877957E+01 WEIGHT=    1.138730D+00 (bending)
7677 ESC=       3.756011E+01 WEIGHT=    1.625800D-01 (SC local)
7678 ETORS=     8.658746E+00 WEIGHT=    1.985990D+00 (torsional)
7679 ETORSD=   -3.650807E-01 WEIGHT=    1.570690D+00 (double torsional)
7680 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7681 ECORR4=   -6.431442E+01 WEIGHT=    4.288700D-01 (multi-body)
7682 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7683 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7684 EELLO=    -4.083900E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7685 ETURN3=    1.665896E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7686 ETURN4=   -2.809986E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7687 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7688 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7689 EDIHC=     0.000000E+00 (dihedral angle constraints)
7690 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7691 UCONST=     0.000000E+00 (Constraint energy)
7692 EDFAD=     5.491269-315 (DFA distance energy)
7693 EDFAT=     6.953158-310 (DFA torsion energy)
7694 EDFAN=     6.953158-310 (DFA NCa energy)
7695 EDFAB=     2.650815-317 (DFA Beta energy)
7696 ETOT=     -8.334629E+01 (total)
7697 RMS deviation from the reference structure:   4.681
7698  % of native contacts:  25.000
7699  % of nonnative contacts:  84.211
7700  contact order:   0.330
7701  TM-score with the reference structure:     0.29
7702
7703
7704  Conformation #         197  sumsl return code            4
7705
7706 Virtual-chain energies:
7707
7708 EVDW=     -5.270935E+01 WEIGHT=    1.352790D+00 (SC-SC)
7709 EVDW2=     4.600203E+01 WEIGHT=    1.593040D+00 (SC-p)
7710 EES=      -9.159463E+01 WEIGHT=    7.153400D-01 (p-p)
7711 EVDWPP=   -2.269199E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7712 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7713 EBE=      -4.033718E+01 WEIGHT=    1.138730D+00 (bending)
7714 ESC=       4.338191E+01 WEIGHT=    1.625800D-01 (SC local)
7715 ETORS=     1.002737E+01 WEIGHT=    1.985990D+00 (torsional)
7716 ETORSD=   -1.607228E+00 WEIGHT=    1.570690D+00 (double torsional)
7717 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7718 ECORR4=   -6.856459E+01 WEIGHT=    4.288700D-01 (multi-body)
7719 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7720 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7721 EELLO=    -2.823195E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7722 ETURN3=    1.817855E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7723 ETURN4=   -1.707506E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7724 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7725 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7726 EDIHC=     0.000000E+00 (dihedral angle constraints)
7727 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7728 UCONST=     0.000000E+00 (Constraint energy)
7729 EDFAD=     5.491269-315 (DFA distance energy)
7730 EDFAT=     6.953158-310 (DFA torsion energy)
7731 EDFAN=     6.953158-310 (DFA NCa energy)
7732 EDFAB=     2.650815-317 (DFA Beta energy)
7733 ETOT=     -8.752376E+01 (total)
7734 RMS deviation from the reference structure:   4.660
7735  % of native contacts:  58.333
7736  % of nonnative contacts:  66.667
7737  contact order:   0.327
7738  TM-score with the reference structure:     0.30
7739
7740
7741  Conformation #         190  sumsl return code            4
7742
7743 Virtual-chain energies:
7744
7745 EVDW=     -5.038684E+01 WEIGHT=    1.352790D+00 (SC-SC)
7746 EVDW2=     4.850926E+01 WEIGHT=    1.593040D+00 (SC-p)
7747 EES=      -1.024879E+02 WEIGHT=    7.153400D-01 (p-p)
7748 EVDWPP=   -1.444056E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7749 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7750 EBE=      -3.961792E+01 WEIGHT=    1.138730D+00 (bending)
7751 ESC=       4.782860E+01 WEIGHT=    1.625800D-01 (SC local)
7752 ETORS=     1.110474E+01 WEIGHT=    1.985990D+00 (torsional)
7753 ETORSD=   -2.777569E-01 WEIGHT=    1.570690D+00 (double torsional)
7754 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7755 ECORR4=   -7.324958E+01 WEIGHT=    4.288700D-01 (multi-body)
7756 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7757 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7758 EELLO=    -2.717872E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7759 ETURN3=    1.743721E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7760 ETURN4=   -7.098839E-01 WEIGHT=    6.623000D-01 (turns, 4th order)
7761 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7762 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7763 EDIHC=     0.000000E+00 (dihedral angle constraints)
7764 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7765 UCONST=     0.000000E+00 (Constraint energy)
7766 EDFAD=     5.491269-315 (DFA distance energy)
7767 EDFAT=     6.953158-310 (DFA torsion energy)
7768 EDFAN=     6.953158-310 (DFA NCa energy)
7769 EDFAB=     2.650815-317 (DFA Beta energy)
7770 ETOT=     -8.406973E+01 (total)
7771 RMS deviation from the reference structure:   2.163
7772  % of native contacts:  50.000
7773  % of nonnative contacts:  66.667
7774  contact order:   0.323
7775  TM-score with the reference structure:     0.31
7776
7777
7778  Conformation #         159  sumsl return code            4
7779
7780 Virtual-chain energies:
7781
7782 EVDW=     -5.279790E+01 WEIGHT=    1.352790D+00 (SC-SC)
7783 EVDW2=     4.320690E+01 WEIGHT=    1.593040D+00 (SC-p)
7784 EES=      -8.623065E+01 WEIGHT=    7.153400D-01 (p-p)
7785 EVDWPP=   -1.609644E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7786 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7787 EBE=      -3.956218E+01 WEIGHT=    1.138730D+00 (bending)
7788 ESC=       5.898284E+01 WEIGHT=    1.625800D-01 (SC local)
7789 ETORS=     9.671271E+00 WEIGHT=    1.985990D+00 (torsional)
7790 ETORSD=   -1.971714E+00 WEIGHT=    1.570690D+00 (double torsional)
7791 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7792 ECORR4=   -6.391228E+01 WEIGHT=    4.288700D-01 (multi-body)
7793 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7794 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7795 EELLO=    -1.117551E+00 WEIGHT=    1.603600D-01 (electrostatic-local)
7796 ETURN3=    1.837988E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7797 ETURN4=   -4.530386E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7798 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7799 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7800 EDIHC=     0.000000E+00 (dihedral angle constraints)
7801 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7802 UCONST=     0.000000E+00 (Constraint energy)
7803 EDFAD=     5.491269-315 (DFA distance energy)
7804 EDFAT=     6.953158-310 (DFA torsion energy)
7805 EDFAN=     6.953158-310 (DFA NCa energy)
7806 EDFAB=     2.650815-317 (DFA Beta energy)
7807 ETOT=     -8.503867E+01 (total)
7808 RMS deviation from the reference structure:   4.715
7809  % of native contacts:  41.667
7810  % of nonnative contacts:  73.684
7811  contact order:   0.337
7812  TM-score with the reference structure:     0.31
7813
7814
7815  Conformation #         131  sumsl return code            4
7816
7817 Virtual-chain energies:
7818
7819 EVDW=     -4.897357E+01 WEIGHT=    1.352790D+00 (SC-SC)
7820 EVDW2=     3.915163E+01 WEIGHT=    1.593040D+00 (SC-p)
7821 EES=      -7.616403E+01 WEIGHT=    7.153400D-01 (p-p)
7822 EVDWPP=   -1.790272E+01 WEIGHT=    1.137100D-01 (p-p VDW)
7823 ESTR=      0.000000E+00 WEIGHT=    1.000000D+00 (stretching)
7824 EBE=      -3.976098E+01 WEIGHT=    1.138730D+00 (bending)
7825 ESC=       3.234261E+01 WEIGHT=    1.625800D-01 (SC local)
7826 ETORS=     8.585411E+00 WEIGHT=    1.985990D+00 (torsional)
7827 ETORSD=   -1.311838E+00 WEIGHT=    1.570690D+00 (double torsional)
7828 EHBP=      0.000000E+00 WEIGHT=    1.000000D+00 (SS bridges & dist. cnstr.)
7829 ECORR4=   -5.707833E+01 WEIGHT=    4.288700D-01 (multi-body)
7830 ECORR5=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7831 ECORR6=    0.000000E+00 WEIGHT=    0.000000D+00 (multi-body)
7832 EELLO=     9.255785E-01 WEIGHT=    1.603600D-01 (electrostatic-local)
7833 ETURN3=    1.512623E+01 WEIGHT=    1.687220D+00 (turns, 3rd order)
7834 ETURN4=   -2.021032E+00 WEIGHT=    6.623000D-01 (turns, 4th order)
7835 ETURN6=    0.000000E+00 WEIGHT=    0.000000D+00 (turns, 6th order)
7836 ESCCOR=    0.000000E+00 WEIGHT=    0.000000D+00 (backbone-rotamer corr)
7837 EDIHC=     0.000000E+00 (dihedral angle constraints)
7838 ESS=       0.000000E+00 (disulfide-bridge intrinsic energy)
7839 UCONST=     0.000000E+00 (Constraint energy)
7840 EDFAD=     5.491269-315 (DFA distance energy)
7841 EDFAT=     6.953158-310 (DFA torsion energy)
7842 EDFAN=     6.953158-310 (DFA NCa energy)
7843 EDFAB=     2.650815-317 (DFA Beta energy)
7844 ETOT=     -8.557646E+01 (total)
7845 RMS deviation from the reference structure:   4.777
7846  % of native contacts:  16.667
7847  % of nonnative contacts:  85.714
7848  contact order:   0.419
7849  TM-score with the reference structure:     0.31
7850 CG processor   0 is finishing work.
7851  Total wall clock time   1.34375000000000       sec