Friday, September 20 2024 17:48:55
UNRES
246.90s
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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 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 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 MPI: node= 2 iseed= -9179228 MPI: node= 1 iseed= -6119485 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 2 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 MPI: node= 3 iseed= -12238971 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 3 0 0 ivec_start 1 ivec_end 21 MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 0 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 End of minim, proc 3 time 1482546856.4437809 End of minim, proc 1 time 1482546856.4438090 End of minim, proc 2 time 1482546856.4438310 End of cycle, master time for 22 iters 46.576700925827026 sec, Eval/s 8852.2371014769105 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 End of minim, proc 2 time 1482546890.2018261 End of minim, proc 3 time 1482546890.2018571 End of minim, proc 1 time 1482546890.2018771 End of cycle, master time for 13 iters 28.693705081939697 sec, Eval/s 8757.8790986518488 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 2 time 1482546951.9964850 End of minim, proc 3 time 1482546951.9965191 End of cycle, master time for 24 iters 56.433418035507202 sec, Eval/s 8005.0972584322535 End of minim, proc 1 time 1482546951.9965420 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 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 1482547051.2760890 End of minim, proc 2 time 1482547051.2761230 End of cycle, master time for 39 iters 93.716429948806763 sec, Eval/s 7924.3735640129944 End of minim, proc 3 time 1482547051.2761459 UPDATING 3 4 End of RUN, master time 241.51363492012024 sec, Eval/s 8249.3975988517577 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 Bye BSTOP STOP Bye Bye... ye... Bye Bye... STOP Bye Bye... Emin= -200.13486 Emin= -200.13486 Emin= -200.13486 Emin= -200.13486 difference 0 from reference emin -200.13486 difference 0 from reference emin -200.13486 difference 0 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 138501 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141605 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152331 m 323 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 172277 m 393 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176131 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183919 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 205819 m 501 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 211046 m 528 rms 2.13 %NC 53.3 ENERGY -1.99552E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 213983 m 538 rms 3.32 %NC 46.7 ENERGY -1.99796E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 217824 m 548 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 241645 m 649 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 340484 m 1026 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 545119 m 1507 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 563580 m 1571 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 622159 m 1767 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 654542 m 1872 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 675120 m 1931 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 689149 m 1969 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 693541 m 1983 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 735790 m 2112 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 753808 m 2170 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 815990 m 2221 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 837537 m 2290 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 855358 m 2341 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 893033 m 2446 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 1417554 m 3616 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 1450158 m 3696 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 1454627 m 3709 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1473276 m 3781 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1490511 m 3851 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@039.pdb:REMAdifference 0 from reference emin -200.13486 RK GM 39 e 1522449 m 3949 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 1544706 m 4014 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 1558954 m 4042 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 1566593 m 4076 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 2018760 m 5207 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 138501 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141605 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152331 m 323 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 172277 m 393 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176131 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183919 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 205819 m 501 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 211046 m 528 rms 2.13 %NC 53.3 ENERGY -1.99552E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 213983 m 538 rms 3.32 %NC 46.7 ENERGY -1.99796E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 217824 m 548 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 241645 m 649 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 340484 m 1026 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 545119 m 1507 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 563580 m 1571 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 622159 m 1767 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 654542 m 1872 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 675120 m 1931 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 689149 m 1969 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 693541 m 1983 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 735790 m 2112 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 753808 m 2170 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 815990 m 2221 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 837537 m 2290 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 855358 m 2341 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 893033 m 2446 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 1417554 m 3616 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 1450158 m 3696 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 1454627 m 3709 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1473276 m 3781 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1490511 m 3851 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1522449 m 3949 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 1544706 m 4014 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 1558954 m 4042 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 1566593 m 4076 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 2018760 m 5207 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 138501 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141605 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152331 m 323 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 172277 m 393 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176131 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183919 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 205819 m 501 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 211046 m 528 rms 2.13 %NC 53.3 ENERGY -1.99552E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 213983 m 538 rms 3.32 %NC 46.7 ENERGY -1.99796E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 217824 m 548 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 241645 m 649 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 340484 m 1026 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 545119 m 1507 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 563580 m 1571 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 622159 m 1767 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 654542 m 1872 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 675120 m 1931 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 689149 m 1969 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 693541 m 1983 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 735790 m 2112 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 753808 m 2170 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 815990 m 2221 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 837537 m 2290 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 855358 m 2341 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 893033 m 2446 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 1417554 m 3616 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 1450158 m 3696 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 1454627 m 3709 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1473276 m 3781 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1490511 m 3851 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1522449 m 3949 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 1544706 m 4014 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 1558954 m 4042 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 1566593 m 4076 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 2018760 m 5207 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 138501 m 270 rms 3.49 %NC 46.7 ENERGY -1.94489E+02 1l2y_csa_local_4P@008.pdb:REMARK GM 8 e 141605 m 279 rms 3.45 %NC 46.7 ENERGY -1.94848E+02 1l2y_csa_local_4P@009.pdb:REMARK GM 9 e 152331 m 323 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 172277 m 393 rms 2.66 %NC 46.7 ENERGY -1.96478E+02 1l2y_csa_local_4P@013.pdb:REMARK GM 13 e 176131 m 404 rms 2.41 %NC 46.7 ENERGY -1.96677E+02 1l2y_csa_local_4P@014.pdb:REMARK GM 14 e 183919 m 426 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@015.pdb:REMARK GM 15 e 205819 m 501 rms 3.18 %NC 46.7 ENERGY -1.98555E+02 1l2y_csa_local_4P@016.pdb:REMARK GM 16 e 211046 m 528 rms 2.13 %NC 53.3 ENERGY -1.99552E+02 1l2y_csa_local_4P@017.pdb:REMARK GM 17 e 213983 m 538 rms 3.32 %NC 46.7 ENERGY -1.99796E+02 1l2y_csa_local_4P@018.pdb:REMARK GM 18 e 217824 m 548 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@019.pdb:REMARK GM 19 e 241645 m 649 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@020.pdb:REMARK GM 20 e 340484 m 1026 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@021.pdb:REMARK GM 21 e 545119 m 1507 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@022.pdb:REMARK GM 22 e 563580 m 1571 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@023.pdb:REMARK GM 23 e 622159 m 1767 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@024.pdb:REMARK GM 24 e 654542 m 1872 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@025.pdb:REMARK GM 25 e 675120 m 1931 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@026.pdb:REMARK GM 26 e 689149 m 1969 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@027.pdb:REMARK GM 27 e 693541 m 1983 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@028.pdb:REMARK GM 28 e 735790 m 2112 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@029.pdb:REMARK GM 29 e 753808 m 2170 rms 3.32 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@030.pdb:REMARK GM 30 e 815990 m 2221 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@031.pdb:REMARK GM 31 e 837537 m 2290 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@032.pdb:REMARK GM 32 e 855358 m 2341 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@033.pdb:REMARK GM 33 e 893033 m 2446 rms 3.33 %NC 46.7 ENERGY -1.99990E+02 1l2y_csa_local_4P@034.pdb:REMARK GM 34 e 1417554 m 3616 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@035.pdb:REMARK GM 35 e 1450158 m 3696 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@036.pdb:REMARK GM 36 e 1454627 m 3709 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@037.pdb:REMARK GM 37 e 1473276 m 3781 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@038.pdb:REMARK GM 38 e 1490511 m 3851 rms 3.28 %NC 46.7 ENERGY -2.00001E+02 1l2y_csa_local_4P@039.pdb:REMARK GM 39 e 1522449 m 3949 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@040.pdb:REMARK GM 40 e 1544706 m 4014 rms 3.37 %NC 46.7 ENERGY -2.00133E+02 1l2y_csa_local_4P@041.pdb:REMARK GM 41 e 1558954 m 4042 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@042.pdb:REMARK GM 42 e 1566593 m 4076 rms 3.38 %NC 46.7 ENERGY -2.00135E+02 1l2y_csa_local_4P@043.pdb:REMARK GM 43 e 2018760 m 5207 rms 3.38 %NC 46.7 ENERGY -2.00135E+02
