Saturday, October 05 2024 09:44:10
UNRES
165.26s
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CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT 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 1 out of 4 rank in CG_COMM 1 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 Inside initialize 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 Inside initializeInside initializeInside initialize MPI: node= 2 iseed= -9179228 MPI: node= 3 iseed= -12238971 MPI: node= 0 iseed= -3059742 MPI: node= 1 iseed= -6119485 indpdb= 0 pdbref= F indpdb= 0 pdbref= F indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Call Read_Bridge. Processor 2 0 0 ivec_start 1 ivec_end 21 ns= 0 Call Read_Bridge. ns= 0 Processor 3 0 0 ivec_start 1 ivec_end 21 Processor 0 0 0 ivec_start 1 ivec_end 21 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 1 0 0 ivec_start 1 ivec_end 21 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 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 1493429511.1626971 End of minim, proc 2 time 1493429511.1627150 End of cycle, master time for 36 iters 49.689575910568237 sec, Eval/s 13825.273961613571 End of minim, proc 3 time 1493429511.2412009 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 UPDATING 100 100 UPDATING 100 100 End of minim, proc 3 time 1493429556.3871050 End of cycle, master time for 30 iters 41.888793945312500 sec, Eval/s 13721.688925930999 End of minim, proc 1 time 1493429556.3871379 End of minim, proc 2 time 1493429556.3871419 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 End of minim, proc 1 time 1493429592.9176331 End of minim, proc 2 time 1493429592.9176619 End of cycle, master time for 24 iters 33.061463117599487 sec, Eval/s 13532.310969076207 End of minim, proc 3 time 1493429592.9176660 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 End of minim, proc 2 time 1493429623.2792759 End of minim, proc 3 time 1493429623.2792940 End of cycle, master time for 19 iters 26.962866067886353 sec, Eval/s 13403.767948483930 End of minim, proc 1 time 1493429623.2793360 UPDATING 3 4 End of RUN, master time 161.79355382919312 sec, Eval/s 13627.848253631479 CG processor 0 is finishing work. CG processor 1 is finishing work. CG processor 2 is finishing work. CG processor 3 is finishing work. STOP ByeSTOP Bye... STOP Bye Bye... Bye Bye... STOP 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 3236 m 1 rms 2.29 %NC 46.7 ENERGY -1.79212E+02 1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 5084 m 2 rms 2.34 %NC 46.7 ENERGY -1.88494E+02 1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 13338 m 5 rms 2.33 %NC 46.7 ENERGY -1.88495E+02 1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 46970 m 15 rms 2.33 %NC 46.7 ENERGY -1.92792E+02 1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 59346 m 41 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 111923 m 189 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 138913 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141741 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152586 m 324 rms 3.03 %NC 46.7 ENERGY -1.96372E+02 1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 159595 m 346 rms 2.40 %NC 46.7 ENERGY -1.96402E+02 1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 171022 m 390 rms 2.40 %NC 46.7 ENERGY -1.96403E+02 1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 172391 m 394 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176373 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183922 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 202366 m 494 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 214354 m 538 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 217002 m 549 rms 2.12 %NC 53.3 ENERGY -1.99267E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 223823 m 572 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 243036 m 644 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 264340 m 718 rms 3.26 %NC 46.7 ENERGY -1.99589E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 297176 m 813 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 308267 m 858 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 363175 m 1050 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 420532 m 1242 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 436270 m 1309 rms 3.28 %NC 46.7 ENERGY -1.99801E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 445763 m 1348 rms 3.50 %NC 46.7 ENERGY -1.99835E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 483659 m 1495 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 507686 m 1591 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 509850 m 1600 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 530640 m 1676 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 682730 m 2216 rms 3.39 %NC 46.7 ENERGY -2.00134E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 714410 m 2337 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 817061 m 2528 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 946727 m 2936 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 971411 m 2999 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 990776 m 3063 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1029831 m 3188 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1068677 m 3305 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1086657 m 3367 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 3236 m 1 rms 2.29 %NC 46.7 ENERGY -1.79212E+02 1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 5084 m 2 rms 2.34 %NC 46.7 ENERGY -1.88494E+02 1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 13338 m 5 rms 2.33 %NC 46.7 ENERGY -1.88495E+02 1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 46970 m 15 rms 2.33 %NC 46.7 ENERGY -1.92792E+02 1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 59346 m 41 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 111923 m 189 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 138913 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141741 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152586 m 324 rms 3.03 %NC 46.7 ENERGY -1.96372E+02 1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 159595 m 346 rms 2.40 %NC 46.7 ENERGY -1.96402E+02 1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 171022 m 390 rms 2.40 %NC 46.7 ENERGY -1.96403E+02 1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 172391 m 394 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176373 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183922 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 202366 m 494 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 214354 m 538 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 217002 m 549 rms 2.12 %NC 53.3 ENERGY -1.99267E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 223823 m 572 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 243036 m 644 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 264340 m 718 rms 3.26 %NC 46.7 ENERGY -1.99589E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 297176 m 813 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 308267 m 858 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 363175 m 1050 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 420532 m 1242 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 436270 m 1309 rms 3.28 %NC 46.7 ENERGY -1.99801E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 445763 m 1348 rms 3.50 %NC 46.7 ENERGY -1.99835E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 483659 m 1495 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 507686 m 1591 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 509850 m 1600 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 530640 m 1676 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 682730 m 2216 rms 3.39 %NC 46.7 ENERGY -2.00134E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 714410 m 2337 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 817061 m 2528 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 946727 m 2936 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 971411 m 2999 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 990776 m 3063 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1029831 m 3188 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1068677 m 3305 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1086657 m 3367 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 3236 m 1 rms 2.29 %NC 46.7 ENERGY -1.79212E+02 1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 5084 m 2 rms 2.34 %NC 46.7 ENERGY -1.88494E+02 1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 13338 m 5 rms 2.33 %NC 46.7 ENERGY -1.88495E+02 1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 46970 m 15 rms 2.33 %NC 46.7 ENERGY -1.92792E+02 1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 59346 m 41 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 111923 m 189 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 138913 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141741 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152586 m 324 rms 3.03 %NC 46.7 ENERGY -1.96372E+02 1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 159595 m 346 rms 2.40 %NC 46.7 ENERGY -1.96402E+02 1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 171022 m 390 rms 2.40 %NC 46.7 ENERGY -1.96403E+02 1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 172391 m 394 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176373 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183922 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 202366 m 494 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 214354 m 538 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 217002 m 549 rms 2.12 %NC 53.3 ENERGY -1.99267E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 223823 m 572 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 243036 m 644 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 264340 m 718 rms 3.26 %NC 46.7 ENERGY -1.99589E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 297176 m 813 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 308267 m 858 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 363175 m 1050 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 420532 m 1242 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 436270 m 1309 rms 3.28 %NC 46.7 ENERGY -1.99801E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 445763 m 1348 rms 3.50 %NC 46.7 ENERGY -1.99835E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 483659 m 1495 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 507686 m 1591 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 509850 m 1600 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 530640 m 1676 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 682730 m 2216 rms 3.39 %NC 46.7 ENERGY -2.00134E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 714410 m 2337 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 817061 m 2528 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 946727 m 2936 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 971411 m 2999 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 990776 m 3063 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1029831 m 3188 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1068677 m 3305 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1086657 m 3367 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 difference .00001 from reference emin -200.13486 1l2y_csa_local_4P@001.pdb:REMARK GM 1 e 3236 m 1 rms 2.29 %NC 46.7 ENERGY -1.79212E+02 1l2y_csa_local_4P@002.pdb:REMARK GM 2 e 5084 m 2 rms 2.34 %NC 46.7 ENERGY -1.88494E+02 1l2y_csa_local_4P@003.pdb:REMARK GM 3 e 13338 m 5 rms 2.33 %NC 46.7 ENERGY -1.88495E+02 1l2y_csa_local_4P@004.pdb:REMARK GM 4 e 46970 m 15 rms 2.33 %NC 46.7 ENERGY -1.92792E+02 1l2y_csa_local_4P@005.pdb:REMARK GM 5 e 59346 m 41 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@006.pdb:REMARK GM 6 e 111923 m 189 rms 2.33 %NC 46.7 ENERGY -1.92797E+02 1l2y_csa_local_4P@007.pdb:REMARK GM 7 e 138913 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141741 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152586 m 324 rms 3.03 %NC 46.7 ENERGY -1.96372E+02 1l2y_csa_local_4P@010.pdb:REMARK GM 10 e 159595 m 346 rms 2.40 %NC 46.7 ENERGY -1.96402E+02 1l2y_csa_local_4P@011.pdb:REMARK GM 11 e 171022 m 390 rms 2.40 %NC 46.7 ENERGY -1.96403E+02 1l2y_csa_local_4P@012.pdb:REMARK GM 12 e 172391 m 394 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176373 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183922 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 202366 m 494 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 214354 m 538 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 217002 m 549 rms 2.12 %NC 53.3 ENERGY -1.99267E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 223823 m 572 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 243036 m 644 rms 3.31 %NC 46.7 ENERGY -1.99587E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 264340 m 718 rms 3.26 %NC 46.7 ENERGY -1.99589E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 297176 m 813 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 308267 m 858 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 363175 m 1050 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 420532 m 1242 rms 3.26 %NC 46.7 ENERGY -1.99590E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 436270 m 1309 rms 3.28 %NC 46.7 ENERGY -1.99801E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 445763 m 1348 rms 3.50 %NC 46.7 ENERGY -1.99835E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 483659 m 1495 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 507686 m 1591 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 509850 m 1600 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 530640 m 1676 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 682730 m 2216 rms 3.39 %NC 46.7 ENERGY -2.00134E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 714410 m 2337 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 817061 m 2528 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 946727 m 2936 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 971411 m 2999 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 990776 m 3063 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1029831 m 3188 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1068677 m 3305 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1086657 m 3367 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
