CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
--------------------------------------------------------------------------
The library attempted to open the following supporting CUDA libraries,
but each of them failed. CUDA-aware support is disabled.
libcuda.so.1: cannot open shared object file: No such file or directory
/usr/lib64/libcuda.so.1: cannot open shared object file: No such file or directory
If you are not interested in CUDA-aware support, then run with
--mca mpi_cuda_support 0 to suppress this message. If you are interested
in CUDA-aware support, then try setting LD_LIBRARY_PATH to the location
of libcuda.so.1 to get passed this issue.
--------------------------------------------------------------------------
Processor 1 out of 4 rank in CG_COMM 1
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
Processor 0 out of 4 rank in CG_COMM 0
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Processor 2 out of 4 rank in CG_COMM 2
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Processor 3 out of 4 rank in CG_COMM 3
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
0 size of FG_COMM1 1
Inside initializeInside initializeInside initializeInside initialize MPI: node= 0 iseed= -3059742
MPI: node= 2 iseed= -9179228
MPI: node= 3 iseed= -12238971
MPI: node= 1 iseed= -6119485
indpdb= 0 pdbref= F
indpdb= 0 pdbref= F
Call Read_Bridge.
ns= 0
Call Read_Bridge.
ns= 0
indpdb= 0 pdbref= F
indpdb= 0 pdbref= F
Call Read_Bridge.
Call Read_Bridge.
ns= 0
ns= 0
Processor 2 0 0 ivec_start 1
ivec_end 21
Processor 0 0 0 ivec_start 1
ivec_end 21
Processor 1 0 0 ivec_start 1
ivec_end 21
Processor 3 0 0 ivec_start 1
ivec_end 21
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
[dell15:171539] 3 more processes have sent help message help-mpi-common-cuda.txt / dlopen failed
[dell15:171539] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of minim, proc 1 time 49.12517905235291
End of minim, proc 2 time 49.12519598007202
End of minim, proc 3 time 49.12846899032593
End of cycle, master time for 32 iters 49.12454700469971
sec, Eval/s 12800.46409262240
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of minim, proc 2 time 95.75791501998901
End of minim, proc 1 time 95.75794506072998
End of minim, proc 3 time 95.75796484947205
End of cycle, master time for 26 iters 42.57700896263123
sec, Eval/s 12189.51290015480
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of minim, proc 3 time 129.0922899246216
End of minim, proc 2 time 129.0923130512238
End of cycle, master time for 23 iters 30.25601696968079
sec, Eval/s 15145.54941118658
End of minim, proc 1 time 129.1072299480438
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of minim, proc 2 time 168.2989640235901
End of minim, proc 1 time 168.2989921569824
End of minim, proc 3 time 168.2990128993988
End of cycle, master time for 28 iters 36.21263098716736
sec, Eval/s 15188.87153476679
UPDATING 3 4
End of RUN, master time 168.3043220043182 sec, Eval/s
13617.78457442819
CG processor 1 is finishing work.
CG processor 3 is finishing work.
CG processor 2 is finishing work.
CG processor 0 is finishing work.
Warning: ieee_invalid is signaling
Warning: ieee_overflow is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_overflow is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_overflow is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_overflow is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Emin= -200.13485
Emin= -200.13485
Emin= -200.13485
Emin= -200.13485
difference .00001 from reference emin -200.13486
difference .00001 from reference emin -200.13486
difference .00001 from reference emin -200.13486
1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 5513 m 1 rms 2.63 %NC 46.7 ENERGY -1.66323E+02
1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 6239 m 2 rms 2.38 %NC 46.7 ENERGY -1.87312E+02
1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 19537 m 5 rms 3.48 %NC 46.7 ENERGY -1.87711E+02
1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 52555 m 20 rms 2.40 %NC 46.7 ENERGY -1.87758E+02
difference .00001 from reference emin -200.13486
1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 64329 m 50 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 77467 m 78 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 80526 m 89 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 85526 m 107 rms 2.46 %NC 46.7 ENERGY -1.88323E+02
1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 93504 m 136 rms 2.47 %NC 46.7 ENERGY -1.88418E+02
1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 107666 m 188 rms 2.62 %NC 46.7 ENERGY -1.88657E+02
1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 132371 m 256 rms 2.30 %NC 46.7 ENERGY -1.88697E+02
1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 133158 m 258 rms 2.50 %NC 46.7 ENERGY -1.89893E+02
1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 149435 m 306 rms 2.33 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 153678 m 317 rms 2.31 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 161648 m 355 rms 2.32 %NC 46.7 ENERGY -1.90195E+02
1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 162108 m 356 rms 2.58 %NC 53.3 ENERGY -1.91065E+02
1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 184422 m 429 rms 2.52 %NC 53.3 ENERGY -1.91122E+02
1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 184945 m 431 rms 2.56 %NC 46.7 ENERGY -1.91440E+02
1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 204379 m 487 rms 2.13 %NC 60.0 ENERGY -1.91896E+02
1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 207390 m 492 rms 2.13 %NC 60.0 ENERGY -1.91901E+02
1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 226614 m 562 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 232089 m 575 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 234649 m 583 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 240870 m 608 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 260375 m 678 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 299718 m 808 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 306006 m 827 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 306742 m 830 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 322435 m 884 rms 2.96 %NC 46.7 ENERGY -1.91940E+02
1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 336003 m 924 rms 2.22 %NC 53.3 ENERGY -1.92180E+02
1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 362740 m 1003 rms 2.22 %NC 53.3 ENERGY -1.92181E+02
1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 363441 m 1008 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 384311 m 1076 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 391084 m 1098 rms 2.80 %NC 53.3 ENERGY -1.93239E+02
1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 392146 m 1102 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 404521 m 1146 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 416426 m 1191 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 419068 m 1203 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 440167 m 1278 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 468735 m 1362 rms 2.22 %NC 53.3 ENERGY -1.99143E+02
1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 479254 m 1406 rms 2.21 %NC 53.3 ENERGY -1.99144E+02
1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 500264 m 1462 rms 2.22 %NC 53.3 ENERGY -1.99145E+02
1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 507736 m 1500 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@044.pdb:REMARK GM 44 e 531732 m 1574 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@045.pdb:REMARK GM 45 e 539549 m 1599 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@046.pdb:REMARK GM 46 e 615583 m 1859 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@047.pdb:REMARK GM 47 e 635037 m 1919 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@048.pdb:REMARK GM 48 e 655058 m 1985 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@049.pdb:REMARK GM 49 e 656927 m 1997 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@050.pdb:REMARK GM 50 e 729555 m 2086 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@051.pdb:REMARK GM 51 e 739507 m 2132 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@052.pdb:REMARK GM 52 e 801823 m 2311 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@053.pdb:REMARK GM 53 e 845026 m 2434 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@054.pdb:REMARK GM 54 e 857312 m 2464 rms 3.32 %NC 46.7 ENERGY -1.99948E+02
1l2y_csa_local_4P@055.pdb:REMARK GM 55 e 885691 m 2544 rms 3.33 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@056.pdb:REMARK GM 56 e 888121 m 2556 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@057.pdb:REMARK GM 57 e 906473 m 2609 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@058.pdb:REMARK GM 58 e 927155 m 2672 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@059.pdb:REMARK GM 59 e 947167 m 2736 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@060.pdb:REMARK GM 60 e 987924 m 2853 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@061.pdb:REMARK GM 61 e 1018979 m 2959 rms 3.38 %NC 46.7 ENERGY -2.00130E+02
1l2y_csa_local_4P@062.pdb:REMARK GM 62 e 1042585 m 3033 rms 3.38 %NC 46.7 ENERGY -2.00134E+02
1l2y_csa_local_4P@063.pdb:REMARK GM 63 e 1043084 m 3035 rms 3.39 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@064.pdb:REMARK GM 64 e 1238288 m 3648 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@065.pdb:REMARK GM 65 e 1306274 m 3705 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@066.pdb:REMARK GM 66 e 1344371 m 3799 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@067.pdb:REMARK GM 67 e 1705659 m 4801 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@068.pdb:REMARK GM 68 e 1734894 m 4896 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@069.pdb:REMARK GM 69 e 1850362 m 5111 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@070.pdb:REMARK GM 70 e 1871612 m 5161 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@071.pdb:REMARK GM 71 e 1893020 m 5220 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@072.pdb:REMARK GM 72 e 1914303 m 5285 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@073.pdb:REMARK GM 73 e 1926443 m 5321 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@074.pdb:REMARK GM 74 e 1952887 m 5412 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 5513 m 1 rms 2.63 %NC 46.7 ENERGY -1.66323E+02
1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 6239 m 2 rms 2.38 %NC 46.7 ENERGY -1.87312E+02
1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 19537 m 5 rms 3.48 %NC 46.7 ENERGY -1.87711E+02
1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 52555 m 20 rms 2.40 %NC 46.7 ENERGY -1.87758E+02
1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 64329 m 50 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 77467 m 78 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 80526 m 89 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 85526 m 107 rms 2.46 %NC 46.7 ENERGY -1.88323E+02
1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 93504 m 136 rms 2.47 %NC 46.7 ENERGY -1.88418E+02
1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 107666 m 188 rms 2.62 %NC 46.7 ENERGY -1.88657E+02
1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 132371 m 256 rms 2.30 %NC 46.7 ENERGY -1.88697E+02
1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 133158 m 258 rms 2.50 %NC 46.7 ENERGY -1.89893E+02
1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 149435 m 306 rms 2.33 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 153678 m 317 rms 2.31 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 161648 m 355 rms 2.32 %NC 46.7 ENERGY -1.90195E+02
1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 162108 m 356 rms 2.58 %NC 53.3 ENERGY -1.91065E+02
1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 184422 m 429 rms 2.52 %NC 53.3 ENERGY -1.91122E+02
1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 184945 m 431 rms 2.56 %NC 46.7 ENERGY -1.91440E+02
1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 204379 m 487 rms 2.13 %NC 60.0 ENERGY -1.91896E+02
1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 207390 m 492 rms 2.13 %NC 60.0 ENERGY -1.91901E+02
1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 226614 m 562 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 232089 m 575 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 234649 m 583 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 240870 m 608 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 260375 m 678 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 299718 m 808 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 306006 m 827 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 306742 m 830 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 322435 m 884 rms 2.96 %NC 46.7 ENERGY -1.91940E+02
1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 336003 m 924 rms 2.22 %NC 53.3 ENERGY -1.92180E+02
1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 362740 m 1003 rms 2.22 %NC 53.3 ENERGY -1.92181E+02
1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 363441 m 1008 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 384311 m 1076 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 391084 m 1098 rms 2.80 %NC 53.3 ENERGY -1.93239E+02
1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 392146 m 1102 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 404521 m 1146 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 416426 m 1191 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 419068 m 1203 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 440167 m 1278 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 468735 m 1362 rms 2.22 %NC 53.3 ENERGY -1.99143E+02
1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 479254 m 1406 rms 2.21 %NC 53.3 ENERGY -1.99144E+02
1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 500264 m 1462 rms 2.22 %NC 53.3 ENERGY -1.99145E+02
1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 507736 m 1500 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@044.pdb:REMARK GM 44 e 531732 m 1574 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@045.pdb:REMARK GM 45 e 539549 m 1599 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@046.pdb:REMARK GM 46 e 615583 m 1859 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@047.pdb:REMARK GM 47 e 635037 m 1919 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@048.pdb:REMARK GM 48 e 655058 m 1985 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@049.pdb:REMARK GM 49 e 656927 m 1997 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@050.pdb:REMARK GM 50 e 729555 m 2086 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@051.pdb:REMARK GM 51 e 739507 m 2132 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@052.pdb:REMARK GM 52 e 801823 m 2311 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@053.pdb:REMARK GM 53 e 845026 m 2434 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@054.pdb:REMARK GM 54 e 857312 m 2464 rms 3.32 %NC 46.7 ENERGY -1.99948E+02
1l2y_csa_local_4P@055.pdb:REMARK GM 55 e 885691 m 2544 rms 3.33 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@056.pdb:REMARK GM 56 e 888121 m 2556 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@057.pdb:REMARK GM 57 e 906473 m 2609 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@058.pdb:REMARK GM 58 e 927155 m 2672 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@059.pdb:REMARK GM 59 e 947167 m 2736 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@060.pdb:REMARK GM 60 e 987924 m 2853 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@061.pdb:REMARK GM 61 e 1018979 m 2959 rms 3.38 %NC 46.7 ENERGY -2.00130E+02
1l2y_csa_local_4P@062.pdb:REMARK GM 62 e 1042585 m 3033 rms 3.38 %NC 46.7 ENERGY -2.00134E+02
1l2y_csa_local_4P@063.pdb:REMARK GM 63 e 1043084 m 3035 rms 3.39 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@064.pdb:REMARK GM 64 e 1238288 m 3648 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@065.pdb:REMARK GM 65 e 1306274 m 3705 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@066.pdb:REMARK GM 66 e 1344371 m 3799 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@067.pdb:REMARK GM 67 e 1705659 m 4801 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@068.pdb:REMARK GM 68 e 1734894 m 4896 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@069.pdb:REMARK GM 69 e 1850362 m 5111 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@070.pdb:REMARK GM 70 e 1871612 m 5161 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@071.pdb:REMARK GM 71 e 1893020 m 5220 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@072.pdb:REMARK GM 72 e 1914303 m 5285 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@073.pdb:REMARK GM 73 e 1926443 m 5321 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@074.pdb:REMARK GM 74 e 1952887 m 5412 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 5513 m 1 rms 2.63 %NC 46.7 ENERGY -1.66323E+02
1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 6239 m 2 rms 2.38 %NC 46.7 ENERGY -1.87312E+02
1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 19537 m 5 rms 3.48 %NC 46.7 ENERGY -1.87711E+02
1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 52555 m 20 rms 2.40 %NC 46.7 ENERGY -1.87758E+02
1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 64329 m 50 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 77467 m 78 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 80526 m 89 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 85526 m 107 rms 2.46 %NC 46.7 ENERGY -1.88323E+02
1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 93504 m 136 rms 2.47 %NC 46.7 ENERGY -1.88418E+02
1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 107666 m 188 rms 2.62 %NC 46.7 ENERGY -1.88657E+02
1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 132371 m 256 rms 2.30 %NC 46.7 ENERGY -1.88697E+02
1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 133158 m 258 rms 2.50 %NC 46.7 ENERGY -1.89893E+02
1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 149435 m 306 rms 2.33 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 153678 m 317 rms 2.31 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 161648 m 355 rms 2.32 %NC 46.7 ENERGY -1.90195E+02
1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 5513 m 1 rms 2.63 %NC 46.7 ENERGY -1.66323E+02
1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 162108 m 356 rms 2.58 %NC 53.3 ENERGY -1.91065E+02
1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 6239 m 2 rms 2.38 %NC 46.7 ENERGY -1.87312E+02
1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 184422 m 429 rms 2.52 %NC 53.3 ENERGY -1.91122E+02
1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 19537 m 5 rms 3.48 %NC 46.7 ENERGY -1.87711E+02
1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 52555 m 20 rms 2.40 %NC 46.7 ENERGY -1.87758E+02
1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 184945 m 431 rms 2.56 %NC 46.7 ENERGY -1.91440E+02
1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 204379 m 487 rms 2.13 %NC 60.0 ENERGY -1.91896E+02
1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 64329 m 50 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 77467 m 78 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 207390 m 492 rms 2.13 %NC 60.0 ENERGY -1.91901E+02
1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 80526 m 89 rms 2.46 %NC 46.7 ENERGY -1.87972E+02
1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 226614 m 562 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 232089 m 575 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 85526 m 107 rms 2.46 %NC 46.7 ENERGY -1.88323E+02
1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 93504 m 136 rms 2.47 %NC 46.7 ENERGY -1.88418E+02
1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 234649 m 583 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 107666 m 188 rms 2.62 %NC 46.7 ENERGY -1.88657E+02
1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 240870 m 608 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 132371 m 256 rms 2.30 %NC 46.7 ENERGY -1.88697E+02
1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 260375 m 678 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 133158 m 258 rms 2.50 %NC 46.7 ENERGY -1.89893E+02
1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 299718 m 808 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 149435 m 306 rms 2.33 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 153678 m 317 rms 2.31 %NC 46.7 ENERGY -1.90194E+02
1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 306006 m 827 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 306742 m 830 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 161648 m 355 rms 2.32 %NC 46.7 ENERGY -1.90195E+02
1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 322435 m 884 rms 2.96 %NC 46.7 ENERGY -1.91940E+02
1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 162108 m 356 rms 2.58 %NC 53.3 ENERGY -1.91065E+02
1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 336003 m 924 rms 2.22 %NC 53.3 ENERGY -1.92180E+02
1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 184422 m 429 rms 2.52 %NC 53.3 ENERGY -1.91122E+02
1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 362740 m 1003 rms 2.22 %NC 53.3 ENERGY -1.92181E+02
1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 184945 m 431 rms 2.56 %NC 46.7 ENERGY -1.91440E+02
1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 204379 m 487 rms 2.13 %NC 60.0 ENERGY -1.91896E+02
1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 363441 m 1008 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 384311 m 1076 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 207390 m 492 rms 2.13 %NC 60.0 ENERGY -1.91901E+02
1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 391084 m 1098 rms 2.80 %NC 53.3 ENERGY -1.93239E+02
1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 226614 m 562 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 232089 m 575 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 392146 m 1102 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 234649 m 583 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 404521 m 1146 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 240870 m 608 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 416426 m 1191 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 260375 m 678 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 419068 m 1203 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 299718 m 808 rms 2.13 %NC 60.0 ENERGY -1.91902E+02
1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 440167 m 1278 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 306006 m 827 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 468735 m 1362 rms 2.22 %NC 53.3 ENERGY -1.99143E+02
1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 306742 m 830 rms 2.13 %NC 53.3 ENERGY -1.91934E+02
1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 479254 m 1406 rms 2.21 %NC 53.3 ENERGY -1.99144E+02
1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 322435 m 884 rms 2.96 %NC 46.7 ENERGY -1.91940E+02
1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 500264 m 1462 rms 2.22 %NC 53.3 ENERGY -1.99145E+02
1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 336003 m 924 rms 2.22 %NC 53.3 ENERGY -1.92180E+02
1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 507736 m 1500 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 362740 m 1003 rms 2.22 %NC 53.3 ENERGY -1.92181E+02
1l2y_csa_local_4P@044.pdb:REMARK GM 44 e 531732 m 1574 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 363441 m 1008 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@045.pdb:REMARK GM 45 e 539549 m 1599 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 384311 m 1076 rms 2.92 %NC 46.7 ENERGY -1.92727E+02
1l2y_csa_local_4P@046.pdb:REMARK GM 46 e 615583 m 1859 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 391084 m 1098 rms 2.80 %NC 53.3 ENERGY -1.93239E+02
1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 392146 m 1102 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@047.pdb:REMARK GM 47 e 635037 m 1919 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 404521 m 1146 rms 2.55 %NC 46.7 ENERGY -1.99071E+02
1l2y_csa_local_4P@048.pdb:REMARK GM 48 e 655058 m 1985 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@049.pdb:REMARK GM 49 e 656927 m 1997 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 416426 m 1191 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 419068 m 1203 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@050.pdb:REMARK GM 50 e 729555 m 2086 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@051.pdb:REMARK GM 51 e 739507 m 2132 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 440167 m 1278 rms 2.55 %NC 46.7 ENERGY -1.99072E+02
1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 468735 m 1362 rms 2.22 %NC 53.3 ENERGY -1.99143E+02
1l2y_csa_local_4P@052.pdb:REMARK GM 52 e 801823 m 2311 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 479254 m 1406 rms 2.21 %NC 53.3 ENERGY -1.99144E+02
1l2y_csa_local_4P@053.pdb:REMARK GM 53 e 845026 m 2434 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 500264 m 1462 rms 2.22 %NC 53.3 ENERGY -1.99145E+02
1l2y_csa_local_4P@054.pdb:REMARK GM 54 e 857312 m 2464 rms 3.32 %NC 46.7 ENERGY -1.99948E+02
1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 507736 m 1500 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@055.pdb:REMARK GM 55 e 885691 m 2544 rms 3.33 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@044.pdb:REMARK GM 44 e 531732 m 1574 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@056.pdb:REMARK GM 56 e 888121 m 2556 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@045.pdb:REMARK GM 45 e 539549 m 1599 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@057.pdb:REMARK GM 57 e 906473 m 2609 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@046.pdb:REMARK GM 46 e 615583 m 1859 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@058.pdb:REMARK GM 58 e 927155 m 2672 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@047.pdb:REMARK GM 47 e 635037 m 1919 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@059.pdb:REMARK GM 59 e 947167 m 2736 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@048.pdb:REMARK GM 48 e 655058 m 1985 rms 2.13 %NC 53.3 ENERGY -1.99556E+02
1l2y_csa_local_4P@049.pdb:REMARK GM 49 e 656927 m 1997 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@060.pdb:REMARK GM 60 e 987924 m 2853 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@050.pdb:REMARK GM 50 e 729555 m 2086 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@061.pdb:REMARK GM 61 e 1018979 m 2959 rms 3.38 %NC 46.7 ENERGY -2.00130E+02
1l2y_csa_local_4P@062.pdb:REMARK GM 62 e 1042585 m 3033 rms 3.38 %NC 46.7 ENERGY -2.00134E+02
1l2y_csa_local_4P@051.pdb:REMARK GM 51 e 739507 m 2132 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@052.pdb:REMARK GM 52 e 801823 m 2311 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@063.pdb:REMARK GM 63 e 1043084 m 3035 rms 3.39 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@053.pdb:REMARK GM 53 e 845026 m 2434 rms 3.29 %NC 46.7 ENERGY -1.99932E+02
1l2y_csa_local_4P@064.pdb:REMARK GM 64 e 1238288 m 3648 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@054.pdb:REMARK GM 54 e 857312 m 2464 rms 3.32 %NC 46.7 ENERGY -1.99948E+02
1l2y_csa_local_4P@065.pdb:REMARK GM 65 e 1306274 m 3705 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@055.pdb:REMARK GM 55 e 885691 m 2544 rms 3.33 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@066.pdb:REMARK GM 66 e 1344371 m 3799 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@056.pdb:REMARK GM 56 e 888121 m 2556 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@067.pdb:REMARK GM 67 e 1705659 m 4801 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@057.pdb:REMARK GM 57 e 906473 m 2609 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@068.pdb:REMARK GM 68 e 1734894 m 4896 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@058.pdb:REMARK GM 58 e 927155 m 2672 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@059.pdb:REMARK GM 59 e 947167 m 2736 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@069.pdb:REMARK GM 69 e 1850362 m 5111 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@060.pdb:REMARK GM 60 e 987924 m 2853 rms 3.32 %NC 46.7 ENERGY -1.99949E+02
1l2y_csa_local_4P@070.pdb:REMARK GM 70 e 1871612 m 5161 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@071.pdb:REMARK GM 71 e 1893020 m 5220 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@061.pdb:REMARK GM 61 e 1018979 m 2959 rms 3.38 %NC 46.7 ENERGY -2.00130E+02
1l2y_csa_local_4P@072.pdb:REMARK GM 72 e 1914303 m 5285 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@062.pdb:REMARK GM 62 e 1042585 m 3033 rms 3.38 %NC 46.7 ENERGY -2.00134E+02
1l2y_csa_local_4P@073.pdb:REMARK GM 73 e 1926443 m 5321 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@074.pdb:REMARK GM 74 e 1952887 m 5412 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@063.pdb:REMARK GM 63 e 1043084 m 3035 rms 3.39 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@064.pdb:REMARK GM 64 e 1238288 m 3648 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@065.pdb:REMARK GM 65 e 1306274 m 3705 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@066.pdb:REMARK GM 66 e 1344371 m 3799 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@067.pdb:REMARK GM 67 e 1705659 m 4801 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@068.pdb:REMARK GM 68 e 1734894 m 4896 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@069.pdb:REMARK GM 69 e 1850362 m 5111 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@070.pdb:REMARK GM 70 e 1871612 m 5161 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@071.pdb:REMARK GM 71 e 1893020 m 5220 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@072.pdb:REMARK GM 72 e 1914303 m 5285 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@073.pdb:REMARK GM 73 e 1926443 m 5321 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
1l2y_csa_local_4P@074.pdb:REMARK GM 74 e 1952887 m 5412 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
171.52s
Show Command Line
Show Test Time Graph
