Branch: rosetta:commits 「revision: №20706」
Test: linux.gcc.mpi.serialization.integration.mpi
SubTest: replica_docking
SubTest files: 「file-system-view」
Daemon: hojo-4    
State: replica_docking

Brief Diff: Files /home/benchmark/working_dir/main:62149/replica_docking/log and /home/benchmark/working_dir/commits:20706/replica_docking/log differ Files /home/benchmark/working_dir/main:62149/replica_docking/logs/log_0 and /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_0 differ Files /home/benchmark/working_dir/main:62149/replica_docking/logs/log_1 and /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_1 differ Files /home/benchmark/working_dir/main:62149/replica_docking/logs/log_2 and /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_2 differ Files /home/benchmark/working_dir/main:62149/replica_docking/logs/log_3 and /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_3 differ Files /home/benchmark/working_dir/main:62149/replica_docking/output/decoys_P_0001_traj.out and /home/benchmark/working_dir/commits:20706/replica_docking/output/decoys_P_0001_traj.out differ Files /home/benchmark/working_dir/main:62149/replica_docking/output/decoys_P_0002_traj.out.oversized and /home/benchmark/working_dir/commits:20706/replica_docking/output/decoys_P_0002_traj.out.oversized differ Files /home/benchmark/working_dir/main:62149/replica_docking/output/scores.fsc and /home/benchmark/working_dir/commits:20706/replica_docking/output/scores.fsc differ Files /home/benchmark/working_dir/main:62149/replica_docking/tempering.stats and /home/benchmark/working_dir/commits:20706/replica_docking/tempering.stats differ Files /home/benchmark/working_dir/main:62149/replica_docking/.test_got_timeout_kill.log and /home/benchmark/working_dir/commits:20706/replica_docking/.test_got_timeout_kill.log differ Files /home/benchmark/working_dir/main:62149/replica_docking/trial.stats and /home/benchmark/working_dir/commits:20706/replica_docking/trial.stats differ Full Diff: diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/log /home/benchmark/working_dir/commits:20706/replica_docking/log 14c14 < mpirun noticed that process rank 1 with PID 1500243 on node nobu-2 exited on signal 9 (Killed). --- > mpirun noticed that process rank 3 with PID 3241059 on node hojo-4 exited on signal 9 (Killed). diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/logs/log_0 /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_0 1,73d0 < core.init: (0) Rosetta version: 2025.12.post.dev+1.HEAD.74f819c 74f819c4dd58142810833fb8e63211f2974ee342 git@github.com:RosettaCommons/rosetta.git 2025-03-24T13:18:17 < core.init: (0) Rosetta extras: [mpi, serialization] < core.init: (0) command: ROSETTA/source/bin/rosetta_scripts.mpiserialization.linuxgccrelease_debug -in:path:database_cache_dir ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug @flags_replica_dock -database ROSETTA/database -testing:INTEGRATION_TEST < basic.random.init_random_generator: (0) Constant seed mode, seed=1111111 seed_offset=0 real_seed=1111111 < basic.random.init_random_generator: (0) RandomGenerator:init: Normal mode, seed=1111111 RG_type=mt19937 < protocols.jd2.PDBJobInputter: (0) Instantiate PDBJobInputter < protocols.jd2.PDBJobInputter: (0) PDBJobInputter::fill_jobs < protocols.jd2.PDBJobInputter: (0) pushed P.pdb nstruct indices 1 - 4 < core.chemical.GlobalResidueTypeSet: (0) Finished initializing fa_standard residue type set. Created 985 residue types < core.chemical.GlobalResidueTypeSet: (0) Total time to initialize 6.74 seconds. < core.import_pose.import_pose: (0) File 'native.pdb' automatically determined to be of type PDB from contents. < core.conformation.Conformation: (0) [ WARNING ] missing heavyatom: CE on residue LYS 31 < core.conformation.Conformation: (0) [ WARNING ] missing heavyatom: NZ on residue LYS 31 < core.conformation.Conformation: (0) [ WARNING ] missing heavyatom: OXT on residue HIS:CtermProteinFull 166 < core.conformation.Conformation: (0) [ WARNING ] missing heavyatom: OXT on residue ARG:CtermProteinFull 253 < core.pack.pack_missing_sidechains: (0) packing residue number 31 because of missing atom number 8 atom name CE < core.pack.task: (0) Packer task: initialize from command line() < core.scoring.ScoreFunctionFactory: (0) SCOREFUNCTION: ref2015 < core.scoring.etable: (0) Starting energy table calculation < core.scoring.etable: (0) smooth_etable: changing atr/rep split to bottom of energy well < core.scoring.etable: (0) smooth_etable: spline smoothing lj etables (maxdis = 6) < core.scoring.etable: (0) smooth_etable: spline smoothing solvation etables (max_dis = 6) < core.scoring.etable: (0) Finished calculating energy tables. < basic.io.database: (0) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv < basic.io.database: (0) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv < basic.io.database: (0) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv < basic.io.database: (0) Database file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv < basic.io.database: (0) Database file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv < basic.io.database: (0) Database file opened: scoring/score_functions/rama/fd/all.ramaProb < basic.io.database: (0) Database file opened: scoring/score_functions/rama/fd/prepro.ramaProb < basic.io.database: (0) Database file opened: scoring/score_functions/omega/omega_ppdep.all.txt < basic.io.database: (0) Database file opened: scoring/score_functions/omega/omega_ppdep.gly.txt < basic.io.database: (0) Database file opened: scoring/score_functions/omega/omega_ppdep.pro.txt < basic.io.database: (0) Database file opened: scoring/score_functions/omega/omega_ppdep.valile.txt < basic.io.database: (0) Database file opened: scoring/score_functions/P_AA_pp/P_AA < basic.io.database: (0) Database file opened: scoring/score_functions/P_AA_pp/P_AA_n < core.scoring.P_AA: (0) shapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated. < basic.io.database: (0) Database file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop < basic.io.database: (0) Database file opened: scoring/score_functions/elec_cp_reps.dat < core.scoring.elec.util: (0) Read 40 countpair representative atoms < core.pack.dunbrack.RotamerLibrary: (0) shapovalov_lib_fixes_enable option is true. < core.pack.dunbrack.RotamerLibrary: (0) Reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/cys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ile.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/lys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/leu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/met.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/pro.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/arg.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ser.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/thr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/val.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (0) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbind.chi2.Definitions.lib diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/logs/log_1 /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_1 1,73d0 < core.init: (1) Rosetta version: 2025.12.post.dev+1.HEAD.74f819c 74f819c4dd58142810833fb8e63211f2974ee342 git@github.com:RosettaCommons/rosetta.git 2025-03-24T13:18:17 < core.init: (1) Rosetta extras: [mpi, serialization] < core.init: (1) command: ROSETTA/source/bin/rosetta_scripts.mpiserialization.linuxgccrelease_debug -in:path:database_cache_dir ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug @flags_replica_dock -database ROSETTA/database -testing:INTEGRATION_TEST < basic.random.init_random_generator: (1) Constant seed mode, seed=1111111 seed_offset=0 real_seed=1111112 < basic.random.init_random_generator: (1) RandomGenerator:init: Normal mode, seed=1111112 RG_type=mt19937 < protocols.jd2.PDBJobInputter: (1) Instantiate PDBJobInputter < protocols.jd2.PDBJobInputter: (1) PDBJobInputter::fill_jobs < protocols.jd2.PDBJobInputter: (1) pushed P.pdb nstruct indices 1 - 4 < core.chemical.GlobalResidueTypeSet: (1) Finished initializing fa_standard residue type set. Created 985 residue types < core.chemical.GlobalResidueTypeSet: (1) Total time to initialize 6.68 seconds. < core.import_pose.import_pose: (1) File 'native.pdb' automatically determined to be of type PDB from contents. < core.conformation.Conformation: (1) [ WARNING ] missing heavyatom: CE on residue LYS 31 < core.conformation.Conformation: (1) [ WARNING ] missing heavyatom: NZ on residue LYS 31 < core.conformation.Conformation: (1) [ WARNING ] missing heavyatom: OXT on residue HIS:CtermProteinFull 166 < core.conformation.Conformation: (1) [ WARNING ] missing heavyatom: OXT on residue ARG:CtermProteinFull 253 < core.pack.pack_missing_sidechains: (1) packing residue number 31 because of missing atom number 8 atom name CE < core.pack.task: (1) Packer task: initialize from command line() < core.scoring.ScoreFunctionFactory: (1) SCOREFUNCTION: ref2015 < core.scoring.etable: (1) Starting energy table calculation < core.scoring.etable: (1) smooth_etable: changing atr/rep split to bottom of energy well < core.scoring.etable: (1) smooth_etable: spline smoothing lj etables (maxdis = 6) < core.scoring.etable: (1) smooth_etable: spline smoothing solvation etables (max_dis = 6) < core.scoring.etable: (1) Finished calculating energy tables. < basic.io.database: (1) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv < basic.io.database: (1) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv < basic.io.database: (1) Database file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv < basic.io.database: (1) Database file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv < basic.io.database: (1) Database file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv < basic.io.database: (1) Database file opened: scoring/score_functions/rama/fd/all.ramaProb < basic.io.database: (1) Database file opened: scoring/score_functions/rama/fd/prepro.ramaProb < basic.io.database: (1) Database file opened: scoring/score_functions/omega/omega_ppdep.all.txt < basic.io.database: (1) Database file opened: scoring/score_functions/omega/omega_ppdep.gly.txt < basic.io.database: (1) Database file opened: scoring/score_functions/omega/omega_ppdep.pro.txt < basic.io.database: (1) Database file opened: scoring/score_functions/omega/omega_ppdep.valile.txt < basic.io.database: (1) Database file opened: scoring/score_functions/P_AA_pp/P_AA < basic.io.database: (1) Database file opened: scoring/score_functions/P_AA_pp/P_AA_n < core.scoring.P_AA: (1) shapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated. < basic.io.database: (1) Database file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop < basic.io.database: (1) Database file opened: scoring/score_functions/elec_cp_reps.dat < core.scoring.elec.util: (1) Read 40 countpair representative atoms < core.pack.dunbrack.RotamerLibrary: (1) shapovalov_lib_fixes_enable option is true. < core.pack.dunbrack.RotamerLibrary: (1) Reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/cys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ile.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/lys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/leu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/met.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/pro.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/arg.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ser.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/thr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/val.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (1) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbind.chi2.Definitions.lib diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/logs/log_2 /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_2 1c1 < core.init: (2) Rosetta version: 2025.12.post.dev+1.HEAD.74f819c 74f819c4dd58142810833fb8e63211f2974ee342 git@github.com:RosettaCommons/rosetta.git 2025-03-24T13:18:17 --- > core.init: (2) Rosetta version: 2025.12.post.dev+335.HEAD.2aeefb1 2aeefb106358422b7a311b0b0b737913acfc9719 git@github.com:RosettaCommons/rosetta.git 2025-04-01T16:14:49 10c10 < core.chemical.GlobalResidueTypeSet: (2) Total time to initialize 6.71 seconds. --- > core.chemical.GlobalResidueTypeSet: (2) Total time to initialize 7.53 seconds. 42,98c42,45 < core.pack.dunbrack.RotamerLibrary: (2) Reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/cys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ile.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/lys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/leu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/met.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/pro.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/arg.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ser.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/thr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/val.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (2) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (2) Finished reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (2) Dunbrack 2010 library took 148.38 seconds to load from ASCII < core.pack.dunbrack.RotamerLibrary: (2) Memory usage: < core.pack.dunbrack.RotamerLibrary: (2) CYS with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (2) ILE with 842400 bytes < core.pack.dunbrack.RotamerLibrary: (2) LYS with 8335520 bytes < core.pack.dunbrack.RotamerLibrary: (2) LEU with 842400 bytes < core.pack.dunbrack.RotamerLibrary: (2) MET with 2803920 bytes < core.pack.dunbrack.RotamerLibrary: (2) PRO with 209320 bytes < core.pack.dunbrack.RotamerLibrary: (2) ARG with 8563824 bytes < core.pack.dunbrack.RotamerLibrary: (2) SER with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (2) THR with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (2) VAL with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (2) ASP with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (2) GLU with 31361400 bytes < core.pack.dunbrack.RotamerLibrary: (2) PHE with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (2) HIS with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (2) ASN with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (2) GLN with 34161624 bytes < core.pack.dunbrack.RotamerLibrary: (2) TRP with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (2) TYR with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (2) Total memory on Dunbrack Libraries: 153284952 bytes. --- > core.pack.dunbrack.RotamerLibrary: (2) shapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated. > core.pack.dunbrack.RotamerLibrary: (2) Binary rotamer library selected: ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin > core.pack.dunbrack.RotamerLibrary: (2) Using Dunbrack library binary file 'ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'. > core.pack.dunbrack.RotamerLibrary: (2) Dunbrack 2010 library took 0.6 seconds to load from binary 36963c36910 < devel.replica_docking.FnatFilter: (2) compute Fnat --- > \0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0devel.replica_docking.FnatFilter: (2) compute Fnat 38406,41484d38352 < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 45719; accepts= 0.1031; energy_drop/trial= -0.00032 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4370; accepts= 0.3524; energy_drop/trial= -0.00068 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4268; accepts= 0.3062; energy_drop/trial= -0.04370 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4394; accepts= 0.3227; energy_drop/trial= -0.01280 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4258; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4152; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4129; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4091; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4150; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4076; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3894; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4000; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 91500 E=-1.04e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 45971; accepts= 0.1025; energy_drop/trial= -0.00031 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4394; accepts= 0.3530; energy_drop/trial= -0.00063 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4284; accepts= 0.3058; energy_drop/trial= -0.04384 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4427; accepts= 0.3228; energy_drop/trial= -0.01341 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4280; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4178; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4144; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4112; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4177; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4098; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3913; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4023; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 92000 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 46203; accepts= 0.1020; energy_drop/trial= -0.00031 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4427; accepts= 0.3531; energy_drop/trial= 0.00055 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4311; accepts= 0.3050; energy_drop/trial= -0.04354 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4453; accepts= 0.3234; energy_drop/trial= -0.01332 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4302; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4202; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4165; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4134; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4195; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4126; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3932; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4051; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 92500 E=-1.04e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 46436; accepts= 0.1015; energy_drop/trial= -0.00026 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4454; accepts= 0.3532; energy_drop/trial= 0.00074 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4334; accepts= 0.3050; energy_drop/trial= -0.04366 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4478; accepts= 0.3225; energy_drop/trial= -0.01353 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4329; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4227; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4194; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4158; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4220; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4147; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3958; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4066; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 93000 E=-1.04e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 46664; accepts= 0.1010; energy_drop/trial= -0.00028 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4480; accepts= 0.3529; energy_drop/trial= 0.00038 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4362; accepts= 0.3058; energy_drop/trial= -0.04304 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4492; accepts= 0.3221; energy_drop/trial= -0.01424 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4356; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4260; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4220; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4190; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4246; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4166; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3977; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4088; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 93500 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 46920; accepts= 0.1005; energy_drop/trial= -0.00031 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4507; accepts= 0.3530; energy_drop/trial= 0.00017 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4384; accepts= 0.3061; energy_drop/trial= -0.04183 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4515; accepts= 0.3218; energy_drop/trial= -0.01462 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4378; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4277; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4244; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4216; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4274; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4179; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 3998; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4109; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 94000 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 47170; accepts= 0.1000; energy_drop/trial= -0.00030 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4529; accepts= 0.3526; energy_drop/trial= -0.00026 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4414; accepts= 0.3058; energy_drop/trial= -0.04192 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4537; accepts= 0.3211; energy_drop/trial= -0.01448 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4399; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4299; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4273; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4240; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4291; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4198; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4017; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4134; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 94500 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 47420; accepts= 0.0995; energy_drop/trial= -0.00022 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4554; accepts= 0.3533; energy_drop/trial= -0.00125 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4435; accepts= 0.3060; energy_drop/trial= -0.04227 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4559; accepts= 0.3211; energy_drop/trial= -0.01480 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4436; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4320; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4289; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4267; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4315; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4219; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4032; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4155; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 95000 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.16091 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 47661; accepts= 0.0991; energy_drop/trial= -0.00027 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4578; accepts= 0.3541; energy_drop/trial= -0.00132 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4460; accepts= 0.3054; energy_drop/trial= -0.04166 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4580; accepts= 0.3212; energy_drop/trial= -0.01399 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4462; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4342; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4313; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4289; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4332; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4246; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4057; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4181; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 95500 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.25097 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 47916; accepts= 0.0986; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4615; accepts= 0.3538; energy_drop/trial= -0.00088 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4480; accepts= 0.3065; energy_drop/trial= -0.04131 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4599; accepts= 0.3216; energy_drop/trial= -0.01409 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4484; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4367; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4336; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4319; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4345; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4262; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4077; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4201; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 96000 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 48169; accepts= 0.0981; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4637; accepts= 0.3535; energy_drop/trial= -0.00090 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4510; accepts= 0.3071; energy_drop/trial= -0.04092 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4616; accepts= 0.3213; energy_drop/trial= -0.01395 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4499; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4386; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4359; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4342; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4377; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4282; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4104; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4220; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 96500 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < \0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0\0core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 48420; accepts= 0.0976; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4666; accepts= 0.3534; energy_drop/trial= -0.00161 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4541; accepts= 0.3068; energy_drop/trial= -0.04045 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4633; accepts= 0.3210; energy_drop/trial= -0.01391 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4529; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4400; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4383; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4366; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4402; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4300; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4121; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4240; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 97000 E=-1.06e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 48674; accepts= 0.0971; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4691; accepts= 0.3543; energy_drop/trial= -0.00121 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4572; accepts= 0.3056; energy_drop/trial= -0.04028 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4654; accepts= 0.3202; energy_drop/trial= -0.01384 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4548; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4422; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4402; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4387; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4421; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4325; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4144; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4261; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 97500 E=-1.05e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 48938; accepts= 0.0965; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4714; accepts= 0.3549; energy_drop/trial= -0.00158 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4599; accepts= 0.3048; energy_drop/trial= -0.04057 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4672; accepts= 0.3193; energy_drop/trial= -0.01392 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4569; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4437; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4428; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4402; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4449; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4343; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4166; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4284; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 98000 E=-1.06e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 49194; accepts= 0.0960; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4728; accepts= 0.3549; energy_drop/trial= -0.00152 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4622; accepts= 0.3048; energy_drop/trial= -0.04044 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4698; accepts= 0.3195; energy_drop/trial= -0.01319 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4587; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4460; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4455; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4431; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4470; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4368; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4184; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4304; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 98500 E=-1.06e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 49438; accepts= 0.0956; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4756; accepts= 0.3543; energy_drop/trial= -0.00177 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4640; accepts= 0.3052; energy_drop/trial= -0.04021 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4719; accepts= 0.3189; energy_drop/trial= -0.01332 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4616; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4484; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4468; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4449; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4491; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4400; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4211; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4329; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 99000 E=-1.06e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < protocols.moves.TrialCounter: (2) RigidBodyPerturb trials= 49691; accepts= 0.0951; energy_drop/trial= -0.00034 < protocols.moves.TrialCounter: (2) br_CA_CA_04 trials= 4776; accepts= 0.3539; energy_drop/trial= -0.00195 < protocols.moves.TrialCounter: (2) br_CA_CA_07 trials= 4665; accepts= 0.3042; energy_drop/trial= -0.03998 < protocols.moves.TrialCounter: (2) br_CA_CA_10 trials= 4745; accepts= 0.3199; energy_drop/trial= -0.01264 < protocols.moves.TrialCounter: (2) br_CA_CA_13 trials= 4634; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_16 trials= 4509; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_19 trials= 4485; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_22 trials= 4472; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_25 trials= 4513; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_28 trials= 4427; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_31 trials= 4227; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (2) br_CA_CA_34 trials= 4357; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.canonical_sampling.SilentTrajectoryRecorder: (2) 99500 E=-1.06e+03 temp_level=1 temperature=1 < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat < core.conformation.util: (2) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.22603 (in Radians) < core.io.silent: (2) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (2) compute Irms < devel.replica_docking.CaIrmsdFilter: (2) compute Irms < devel.replica_docking.FnatFilter: (2) compute Fnat < devel.replica_docking.LrmsdFilter: (2) compute Lrmsd < devel.replica_docking.FnonnatFilter: (2) compute Fnonnat diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/logs/log_3 /home/benchmark/working_dir/commits:20706/replica_docking/logs/log_3 1c1 < core.init: (3) Rosetta version: 2025.12.post.dev+1.HEAD.74f819c 74f819c4dd58142810833fb8e63211f2974ee342 git@github.com:RosettaCommons/rosetta.git 2025-03-24T13:18:17 --- > core.init: (3) Rosetta version: 2025.12.post.dev+335.HEAD.2aeefb1 2aeefb106358422b7a311b0b0b737913acfc9719 git@github.com:RosettaCommons/rosetta.git 2025-04-01T16:14:49 10c10 < core.chemical.GlobalResidueTypeSet: (3) Total time to initialize 6.68 seconds. --- > core.chemical.GlobalResidueTypeSet: (3) Total time to initialize 7.55 seconds. 42,98c42,45 < core.pack.dunbrack.RotamerLibrary: (3) Reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/cys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ile.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/lys.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/leu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/met.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/pro.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/arg.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/ser.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/thr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/val.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/glu.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/phe.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/his.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/asn.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/gln.bbind.chi3.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/trp.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbdep.rotamers.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbdep.densities.lib < core.pack.dunbrack.RotamerLibrary: (3) Reading ROSETTA/database/rotamer/shapovalov/StpDwn_0-0-0/tyr.bbind.chi2.Definitions.lib < core.pack.dunbrack.RotamerLibrary: (3) Finished reading Dunbrack Libraries < core.pack.dunbrack.RotamerLibrary: (3) Dunbrack 2010 library took 150.37 seconds to load from ASCII < core.pack.dunbrack.RotamerLibrary: (3) Memory usage: < core.pack.dunbrack.RotamerLibrary: (3) CYS with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (3) ILE with 842400 bytes < core.pack.dunbrack.RotamerLibrary: (3) LYS with 8335520 bytes < core.pack.dunbrack.RotamerLibrary: (3) LEU with 842400 bytes < core.pack.dunbrack.RotamerLibrary: (3) MET with 2803920 bytes < core.pack.dunbrack.RotamerLibrary: (3) PRO with 209320 bytes < core.pack.dunbrack.RotamerLibrary: (3) ARG with 8563824 bytes < core.pack.dunbrack.RotamerLibrary: (3) SER with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (3) THR with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (3) VAL with 250800 bytes < core.pack.dunbrack.RotamerLibrary: (3) ASP with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (3) GLU with 31361400 bytes < core.pack.dunbrack.RotamerLibrary: (3) PHE with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (3) HIS with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (3) ASN with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (3) GLN with 34161624 bytes < core.pack.dunbrack.RotamerLibrary: (3) TRP with 11326928 bytes < core.pack.dunbrack.RotamerLibrary: (3) TYR with 10393520 bytes < core.pack.dunbrack.RotamerLibrary: (3) Total memory on Dunbrack Libraries: 153284952 bytes. --- > core.pack.dunbrack.RotamerLibrary: (3) shapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated. > core.pack.dunbrack.RotamerLibrary: (3) Binary rotamer library selected: ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin > core.pack.dunbrack.RotamerLibrary: (3) Using Dunbrack library binary file 'ROSETTA/.database-binaries/mpiserialization.linuxgccrelease_debug/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'. > core.pack.dunbrack.RotamerLibrary: (3) Dunbrack 2010 library took 0.61 seconds to load from binary 3900c3847 < core.pack.annealer.FixbbSimAnnealer: (3) pack_rotamers run final: K, best_energy: -1.79956 --- > core.pack.annealer.FixbbSimAnnealer: (3) pack_rotamers run final: K, best_energy: -1.79957 3926,3932d3872 < core.conformation.util: (3) Non-ideal residue detected: Residue #1 atom #3( C ) : Ideal theta=1.20079, Inspected theta=1.18479 (in Radians) < core.io.silent: (3) detected attempt to write non-ideal pose to silent-file...Automatically switching to binary silent-struct type < devel.replica_docking.IrmsdFilter: (3) compute Irms < devel.replica_docking.CaIrmsdFilter: (3) compute Irms < devel.replica_docking.FnatFilter: (3) compute Fnat < devel.replica_docking.LrmsdFilter: (3) compute Lrmsd < devel.replica_docking.FnonnatFilter: (3) compute Fnonnat 3938,3954c3878,3900 < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 RigidBodyPerturb trials= 16; accepts= 0.4375; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_04 trials= 5; accepts= 0.2000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_07 trials= 5; accepts= 0.2000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_10 trials= 2 NO ACCEPTS. < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_13 trials= 1; accepts= 1.0000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_19 trials= 2; accepts= 1.0000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_25 trials= 2; accepts= 1.0000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_28 trials= 1; accepts= 1.0000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_31 trials= 4; accepts= 1.0000; < protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_34 trials= 2; accepts= 1.0000; < protocols.moves.TrialCounter: (3) RigidBodyPerturb trials= 16; accepts= 0.4375; energy_drop/trial= -0.06288 < protocols.moves.TrialCounter: (3) br_CA_CA_04 trials= 5; accepts= 0.2000; energy_drop/trial= 0.04106 < protocols.moves.TrialCounter: (3) br_CA_CA_07 trials= 5; accepts= 0.2000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (3) br_CA_CA_10 trials= 2 NO ACCEPTS. < protocols.moves.TrialCounter: (3) br_CA_CA_13 trials= 1; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (3) br_CA_CA_19 trials= 2; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (3) br_CA_CA_25 trials= 2; accepts= 1.0000; energy_drop/trial= 0.00000 --- > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 RigidBodyPerturb trials= 9; accepts= 0.1111; > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_04 trials= 1 NO ACCEPTS. > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_07 trials= 2; accepts= 0.5000; > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_10 trials= 1 NO ACCEPTS. > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_25 trials= 3; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_31 trials= 2; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 2 temperature 2.00 br_CA_CA_34 trials= 1; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 RigidBodyPerturb trials= 6; accepts= 0.5000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_04 trials= 2; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_07 trials= 2; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_10 trials= 1; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_16 trials= 1; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_22 trials= 2; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_25 trials= 1; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_28 trials= 1; accepts= 1.0000; > protocols.canonical_sampling.TrialCounter: (3) level 3 temperature 3.00 br_CA_CA_34 trials= 3; accepts= 1.0000; > protocols.moves.TrialCounter: (3) RigidBodyPerturb trials= 15; accepts= 0.2667; energy_drop/trial= 0.05447 > protocols.moves.TrialCounter: (3) br_CA_CA_04 trials= 3; accepts= 0.6667; energy_drop/trial= -0.15114 > protocols.moves.TrialCounter: (3) br_CA_CA_07 trials= 4; accepts= 0.7500; energy_drop/trial= -0.38569 > protocols.moves.TrialCounter: (3) br_CA_CA_10 trials= 2; accepts= 0.5000; energy_drop/trial= 0.00000 > protocols.moves.TrialCounter: (3) br_CA_CA_16 trials= 1; accepts= 1.0000; energy_drop/trial= 0.00000 > protocols.moves.TrialCounter: (3) br_CA_CA_22 trials= 2; accepts= 1.0000; energy_drop/trial= 0.00000 > protocols.moves.TrialCounter: (3) br_CA_CA_25 trials= 4; accepts= 1.0000; energy_drop/trial= 0.00000 3956,3957c3902,3903 < protocols.moves.TrialCounter: (3) br_CA_CA_31 trials= 4; accepts= 1.0000; energy_drop/trial= 0.00000 < protocols.moves.TrialCounter: (3) br_CA_CA_34 trials= 2; accepts= 1.0000; energy_drop/trial= 0.00000 --- > protocols.moves.TrialCounter: (3) br_CA_CA_31 trials= 2; accepts= 1.0000; energy_drop/trial= 0.00000 > protocols.moves.TrialCounter: (3) br_CA_CA_34 trials= 4; accepts= 1.0000; energy_drop/trial= 0.00000 3973c3919 < core.pack.annealer.FixbbSimAnnealer: (3) pack_rotamers run final: E, best_energy: 1.77981 --- > core.pack.annealer.FixbbSimAnnealer: (3) pack_rotamers run final: E, best_energy: 1.77982 3977,3978d3922 < protocols.docking.DockingInitialPerturbation: (3) sliding into contact for full-atom mode < protocols.docking.DockingInitialPerturbation: (3) Sliding Pose components together into contact diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/output/decoys_P_0001_traj.out /home/benchmark/working_dir/commits:20706/replica_docking/output/decoys_P_0001_traj.out 4c4 < SCORE: -917.819 -1400.109 381.743 0.000 0.000 111.182 -38.164 27.528 2.000 2.000 1.867 253.000 -2.563 3.502 3.716 0.242 4.175 0.077 P_0001_002_00000001 --- > SCORE: -1045.066 -1400.109 254.495 0.000 0.000 111.182 -38.164 27.528 3.000 3.000 1.867 253.000 -2.563 3.502 3.716 0.242 4.175 0.077 P_0001_002_00000001 263c263 < SCORE: -1036.325 -1391.181 254.038 0.000 0.000 111.179 -38.097 27.736 3.000 3.000 2.848 251.000 -0.500 4.204 4.431 0.061 5.902 0.000 P_0001_003_00000001 --- > SCORE: -909.306 -1391.181 381.056 0.000 0.000 111.179 -38.097 27.736 2.000 2.000 2.848 251.000 -0.500 4.204 4.431 0.061 5.902 0.000 P_0001_003_00000001 781,1298d780 < SCORE: -910.855 -1392.746 381.663 0.000 0.000 110.323 -38.125 28.031 2.000 2.000 2.625 249.000 -2.261 4.213 4.468 0.061 5.256 0.051 P_0001_002_00000002 < RES_NUM A:1-166 B:14-100 P_0001_002_00000002 < FOLD_TREE EDGE 1 79 -1 EDGE 79 166 -1 EDGE 79 218 1 EDGE 218 167 -1 EDGE 218 253 -1 P_0001_002_00000002 < RT -0.366176 0.504196 0.782113 0.930225 0.2204 0.293438 -0.0244275 0.834991 -0.549721 -14.3487 -32.6635 0.0577885 P_0001_002_00000002 < ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]TEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHQYREQIKRVKDSDDVPMVLVGNKCDLAARTVESRQAQDLARSYGIPYIETSAKTRQGVEDAFYTLVREIRQH[HIS:CtermProteinFull]G[GLY:NtermProteinFull]DCCIIRVSLDVDNGNMYKSILVTSQDKAPTVIRKAMDKHNLDEDEPEDYELLQIISEDHKLKIPENANVFYAMNSAANYDFILKKR[ARG:CtermProteinFull] P_0001_002_00000002 < CHAIN_ENDINGS 166 P_0001_002_00000002 < LoFFlCJwqYLkYQEfQCsWkCdR2YLkEDKfQNzIkCJw6XLERL2fQc9gkCNIgWL0HFGgQZT/jCFpBXLkcloeQ4dKkClyFULEUoreQg3rjCNg7RL06NIeQdI1jCpqQTLkUYUdQO1MlCRBTZLEm4meQiuTlClI0ZLEgAafQacOlCROxWLEg6HfQFoNkCdF8aLUWLGfQb0cjCpzNXLU/lseQwFHkCNqsXLEhTIeQBMskCh7zTLUO/jeQgHFkC9MZTLUQPMfQY0jjCZ5ESLEpv8cQ3AqjCF8UVLUPNTdQlSXkCtmMTLkbTNdQ P_0001_002_00000002 < LEYhjCRKsYLE7RBgQtdOjCBB2XL0LdVgQnELjCxe0ULUNeVgQY66iCxfqTL0KHGgQDIhiClu8YL0UGZgQLKliCFjzbLk4SZgQJBNiC9Q/XLE14tgQxeQjCFq5ZLEF+ufQh7jjCJ9cYLUTUigQzYMiC5xUYL08/LgQDmCjCVWScLkBJXgQZEthCps1YLEbfvgQi2KiCVC0VL0yvtgQLtgiCB+nYL0tV7gQ P_0001_002_00000002 < LcScjC9mkTLkEDmgQGZXjCFZrQL0MzogQqx7iClYAQLEoa8gQiB9iCtIbRLECsMhQfMBkCNSPPL09TsgQZthkC5jnPLUg6ZgQZwHlC1PqNLEBrZgQIwPlCJgOMLkBSpgQ3fdlCRHhNL0nRJgQjFtjChsnULE9AxgQM2GjCth5PLUlwagQN6PkCll8PLEAF7gQMM7jCdpGNLkBLugQ2ERkCJzZPL0/rKgQnpukCB2oRLURtagQ P_0001_002_00000002 < LMIgiCBr8NLUwK7gQSMEiCBAQNLEqGNhQR2OiChUYKLUwKThQ6mMiCBVjIL0NJGhQvGVhCVzYNLkPrHhQMUEhCVoMQLEnoChQj0+gC9RARLUgjtgQHs6gCZX7RL0aSThQCkvgCxKjTL0LBpgQJbrgCRIeULUoFPhQX/lgCN/PVLUS45gQblXgCp8zXLkdq1gQtkeiC9/2MLk+ktgQV3LiCB7kOLU9ZahQklOhCVIIMLUiz5gQ3aChCpzmML0FAVhQwfGhC50oPLU6gggQ1K/gCFZSRLUtzjhQTSrgChULULUadYgQx7jgCZj0VLU1QchQNITgCVkvYLUa6ChQ P_0001_002_00000002 < LMIciCRgFKL00NnhQTipiCdTiHLERLwhQMIEiCVNOGL0577hQxg4hCNH6GLk++NiQNfNjClRyHLkVWAiQUj2jCFKEJLEuk3hQEcdkCBPcHLUbE+hQFAakChkiELEVQ1hQQZQkCpEjCLEd1FiQ4yciCNAvLL0NjwhQjyyiCNBPGL0c9ihQauCjC1H/IL0W4NiQUuVjCZyzFL0WdGiQjz0jC5lKJLkeKmhQnn5jCV4FLLUYy9hQGS6kCxtYILUTy3hQXtfkCBaYHLkwdPiQD0AkC9pcELELPphQvG4kCpw+DLk+qthQnmOkCxrtAL0cH/hQS0nkCR9jCLE2+QiQGK0jCVu/CLEL1MiQ P_0001_002_00000002 < 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Lo13uCB3cYK0XljgQUVKvCdrNZK0AIPgQXKFvC1wPcKkYCLgQYXevCN/XdKk8Z9fQOV1uCt60XKU/93fQmmauCRylXKk/3jgQvgsvClMyYKUBuPgQ7sEvCdRfYK0EgafQw44uCxsqVKUnJ7fQ4dTuC9bVYKkD92fQ P_0001_002_00000002 < Lb9kuC9wrdKEliUgQqUhuCVtkgKUkORgQpyEvC5lXiK0OEagQoMYvCZlihK0zepgQQc6tCFBxhK0sRbgQX95tChzghKEG6zgQ5MUtCp1ojKUMvBhQE4nsClIfhKkPs+gQ6XPuC19vcKUn9dgQX0huCFs8gKUUDAgQdb4tC9I4jKEYHXgQw6dtCpfygK0a8UgQDXytChcdfKk7W4gQHjZuC9g/hKEAO6gQD0LsCptYiKUkJGhQDrhsCpsKhKEOttgQHuusC5pkfKkMVGhQ P_0001_002_00000002 < LKUPvClbvkK0DXRgQWnqvCp5mmKExzcgQUvQvC5tLoKUXdtgQ7l7uCtlPqKk0IpgQ2P/vCRproKURdOgQFkhwCNEaqK06yYgQYXjwC1l8qKE60rgQL6+wCp5nrKEfqNgQDQEvCRpPlK0GuCgQWzCwCV9clKEAXlgQW+NwCJUsnKEawAgQPxmvChCCqKk4TIgQ89UxChfvsK0/CVgQtZ/wC1IcrKE7e7fQ P_0001_002_00000002 < Ld3SvC5XRnKEQaBhQZL/uCpEyoKEi9ShQOuUvC1lVrKEvpahQNpHvCJlfsK0ziqhQE27uCVpLnKEP+nhQ74duCRk/kK0ZlnhQZAivCJOilKUlsEhQMsfuC5xcpK0CpNhQ5GbvC1JXmKU4CshQAYyuCJ7goKk560hQdmRuCdh/kKkPgZhQ P_0001_002_00000002 < LyV1vCJuVsKUHBQhQNpCwCN7FvKESMThQfMvvCFxDxKUtyChQNVzvCpihzKU7sEhQsaywCVyfvKU+JRhQaeFwCt+LrKUieFhQbT3vCt1uvKU33ihQ7F6wC5VmxKUztThQt3CxC5FSuKEJFdhQOx8wC1o5uKkEOBhQ P_0001_002_00000002 < LrFdvCpD8vKkXSxgQsKIvCx/ixKUhsggQAbYuCFk9xKUWKkgQLQFuCZXpwKETwxgQN8KvChIUwKEPeKgQgEevCZg7tKEQpvgQYfWvCVNizKk96ggQtz6uCVBnxKEN/9fQcbsvC97FwKEN7FgQ8l7uCJBXuK0xjKgQ P_0001_002_00000002 < L0KDuCpxzzKUXWZgQSuVtCROD0K0dYcgQ+e7sClvrxKErOUgQDoDtClinwK0L8CgQYUCtClkb2KUX3QgQV8MtCpax2KE5SzfQw4StCFwC5K0m6mfQD+OtCtm40KUY+VfQxCSuCFcD1KUWBPgQUkPtC9DK0Kk8itgQhgfsCpsU2KE30RgQUPMtCtbR4K0gxYgQpbWtCdmW1KUhw3eQXDJtC18+yKUM6dfQ P_0001_002_00000002 < LJScsChgywKEzOhgQ8JAsCtBcuKkNZdgQNFgrCNIauKkSfKgQIE7qCFnhtKkj0MgQ1IhrC550tKEBbwgQoj4rCRylsKEzWDhQx3GsCxu+pKk63BhQQCCsCNoAuKkcrVhQgcisCN89oKEt3QhQevdsCZ7+sKEkdkhQ7cusCdqeqKEL9hhQ+oLtCxxhpKEZVwhQleYsCFe3xKUFxugQZkUsCJMusKEv+ZgQumRrCpCrvKEVj1gQIIIrCpodsK0LFrgQ/N8rCNrtoK0ft0gQBYzrCVU9vKk1aYhQpltsC9K6mKEKmPhQfrmsCBkKuKkLbyhQJ0QtCN+2qK0hG7hQ P_0001_002_00000002 < LDUurC51fvKUU5wfQz2UrCZS8vKUMrKfQ9EgrClh3tKEgNoeQsZFsCZBNtKkl9geQbUcrCpTtyKEHC2eQUWQrCR9G1KEZfSfQ1U9qCVX10KElxzfQaqarCtTX3K0EEHfQFcNsCVqCwKEM7wfQfSzqChFrvKkCLTfQy99rCFj6yKkJbteQasJrCxA3yK0IoYeQ P_0001_002_00000002 < Lwr/qCRudsKku5XeQ/0FrCBjMqK0bc7dQUZrqClnTqK0DsSdQaQIqClNYrKkYDSdQVu5qCtMknKk+OPeQcDUrClUkmKEWy0eQUEPrCFRrnKkWXdfQN0wrCNSakKkjqueQ91orCByvmKkAI/fQxOJsCJIfjKUOsQfQ6fFsCZtqkKE/w4fQwohqChIBtKkS3feQ/NnrCF/LqKExQxdQ0zYqCNTqnKUZmaeQqT7qCZ1/lKEBG3dQaR3qC5ePpK0BNifQ/1zrCxqejK0PQPeQAZmrCpZqnKUgVPgQyZfsC1J1hKkH7LfQhMZsC1M9jKkalJgQ P_0001_002_00000002 < LcQ7qClFOpK0jGwcQIsiqCp5qoKkwbJcQq2TqCZbulKUsMEcQSIqqCN4vjKEfnMcQdP8qCxTPpKkR6ebQNWGrCJxMsKkQ9ZbQpxmqCJ+VoKE1D2aQU2fqCBUFuKEyTYbQUqarCBsvoK0x3wcQweFqCx02pK0huKcQZ+arCRnNoK0tDgbQWZarCpm2sKkef0bQleYrCx4gsKUxk8aQnH7qC1X1oKkI2aaQdlhqCdLMmK0OH3aQYGIqClCXpKUksyaQb8qqC91IwKUBuUbQDmLqCRhjtKEKL9aQliNqC5v5tK0i01bQ P_0001_002_00000002 < LgdrpCtCblKUFE4bQ1ObpCRu4iKkheobQkYepClVBjK05d4aQSgHpCl0gkKkoljaQH0soCJtXiKESn0bQH8aoCZ4mfKETWubQFl2oCpJvdKU4cJcQCtsnCxmdfKkO36bQheXpCBbAnKEKw5bQU+vpCpwThKUQp0bQeqooC5j1iKkHZWcQKfYoCpbtjKkaEibQxsdoCpxCfK0jwMbQiAroCdMsbKkjHGcQZsXpCFH2dKUAo+bQmw0oCNiVeKEj6qcQY5gnClybdK0N31bQnTpnCJw/fKUKhccQVOanCle2gKU2UnbQ P_0001_002_00000002 < LE0/pCNHvhKkqPoaQiFJqCJizhKk/f7ZQpC5pCVrSfKUTbkZQVbEqCRvAdKU3mvZQCX4qCBj8hKE5sxZQdKDrCRG/hKEBeCZQJNyrCpTUiKE+0AZQ5RDsCJVlhK0f/UYQbvwsChp6gKEZrZYQrKTqC91rgKEC77aQAL4pCFbgjKkUstZQX4FrC1lvjKEcGAaQqhIrC5yOgKEh8/ZQcv4qClnHgKEtuzYQdYyqCpoojKUADzYQrc6rCh+YkKEx7HZQyEBsChYChK070YZQiXxrCR34fKEeaIYQiB/rCZDRjK06e+XQ++8sCRyagKUYr5XQ6qAtCJ5giKkqclYQk7zsC53WfK0e+tYQ P_0001_002_00000002 < LtkcpClmofKEyiEZQQHQpCZqZdKE/spYQodypChbhcKEYkJYQ1T4pCJltdKEUHQXQ5kqoCBV9dKkV9OYQOwVoC5ZRbKk28MYQv8ynCtkObKU3ZVXQpGvnCdSVYKUcV3WQlgYoCZnXXKE/0YWQBoPpCB/chK09B/YQrbKpCpmrbK0vZ+YQPGXoCZDgfKEVFeYQr+0oCdvueKkeEgXQ1vtoC5dwZKU8hFYQHoHoCJOzaKE36rYQZ8UnC1j8bKkvrwXQo/7nCRHjcKUa8gWQgGknC1mFXK0gHsXQYnXnCRWNYKUB7DWQ3oVoCVCdVKk2DFWQycioCtJhYK0lenVQNHuoCR9dXK0wyIXQ P_0001_002_00000002 < Li1KqCRUeaKUZSWYQraqqCZ8EZKEw62XQpGXqC141XKUBMlWQB2iqCNHZYKkXybVQtv6pCN4OWKk/iqWQ1CArCBguWKEfESYQm/frCN05UK0X41XQ4KJsCxBWWKUB5fXQQQqsCpTwUKEbj5WQgMnsCNbWTKkfMvVQKTDsCdTxSKkJ5DVQMeKtCV7jSKUZwHVQWmGqC5I4ZKE830YQkACrCtpiaKUUvhXQe4RrClRdXKERotYQ3tnqCNcWVK0g6dYQy5nrCFRNTKU9YPYQNzRrCReLUK0Te6WQpdCsCxj8XKUKkyWQkDXsCh9LXKEC8MYQ8uGtC9wpUK04HYXQ6pmrCxaZTKExKaVQi6EsCtRtRKU1CNUQxbntCVKATKUg4gVQzdItCtOhRKUEmQUQ P_0001_002_00000002 < SCORE: -1038.261 -1393.560 254.184 0.000 0.000 111.181 -38.026 27.959 3.000 3.000 3.042 249.000 -0.338 4.715 5.204 0.061 7.975 0.077 P_0001_003_00000002 < RES_NUM A:1-166 B:14-100 P_0001_003_00000002 < FOLD_TREE EDGE 1 79 -1 EDGE 79 166 -1 EDGE 79 218 1 EDGE 218 167 -1 EDGE 218 253 -1 P_0001_003_00000002 < RT -0.142179 0.371011 0.91768 0.941118 0.337954 0.00917796 -0.306728 0.86495 -0.397215 -20.4846 -29.1818 -2.69106 P_0001_003_00000002 < ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]TEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHQYREQIKRVKDSDDVPMVLVGNKCDLAARTVESRQAQDLARSYGIPYIETSAKTRQGVEDAFYTLVREIRQH[HIS:CtermProteinFull]G[GLY:NtermProteinFull]DCCIIRVSLDVDNGNMYKSILVTSQDKAPTVIRKAMDKHNLDEDEPEDYELLQIISEDHKLKIPENANVFYAMNSAANYDFILKKR[ARG:CtermProteinFull] P_0001_003_00000002 < CHAIN_ENDINGS 166 P_0001_003_00000002 < LoFFlCJwqYLkYQEfQCsWkCdR2YLkEDKfQNzIkCJw6XLERL2fQc9gkCNIgWL0HFGgQZT/jCFpBXLkcloeQ4dKkClyFULEUoreQg3rjCNg7RL06NIeQdI1jCpqQTLkUYUdQO1MlCRBTZLEm4meQiuTlClI0ZLEgAafQacOlCROxWLEg6HfQFoNkCdF8aLUWLGfQb0cjCpzNXLU/lseQwFHkCNqsXLEhTIeQBMskCh7zTLUO/jeQgHFkC9MZTLUQPMfQY0jjCZ5ESLEpv8cQ3AqjCF8UVLUPNTdQlSXkCtmMTLkbTNdQ P_0001_003_00000002 < LEYhjCRKsYLE7RBgQtdOjCBB2XL0LdVgQnELjCxe0ULUNeVgQY66iCxfqTL0KHGgQDIhiClu8YL0UGZgQLKliCFjzbLk4SZgQJBNiC9Q/XLE14tgQxeQjCFq5ZLEF+ufQh7jjCJ9cYLUTUigQzYMiC5xUYL08/LgQDmCjCVWScLkBJXgQZEthCps1YLEbfvgQi2KiCVC0VL0yvtgQLtgiCB+nYL0tV7gQ P_0001_003_00000002 < LcScjC9mkTLkEDmgQGZXjCFZrQL0MzogQqx7iClYAQLEoa8gQiB9iCtIbRLECsMhQfMBkCNSPPL09TsgQZthkC5jnPLUg6ZgQZwHlC1PqNLEBrZgQIwPlCJgOMLkBSpgQ3fdlCRHhNL0nRJgQjFtjChsnULE9AxgQM2GjCth5PLUlwagQN6PkCll8PLEAF7gQMM7jCdpGNLkBLugQ2ERkCJzZPL0/rKgQnpukCB2oRLURtagQ P_0001_003_00000002 < LMIgiCBr8NLUwK7gQSMEiCBAQNLEqGNhQR2OiChUYKLUwKThQ6mMiCBVjIL0NJGhQvGVhCVzYNLkPrHhQMUEhCVoMQLEnoChQj0+gC9RARLUgjtgQHs6gCZX7RL0aSThQCkvgCxKjTL0LBpgQJbrgCRIeULUoFPhQX/lgCN/PVLUS45gQblXgCp8zXLkdq1gQtkeiC9/2MLk+ktgQV3LiCB7kOLU9ZahQklOhCVIIMLUiz5gQ3aChCpzmML0FAVhQwfGhC50oPLU6gggQ1K/gCFZSRLUtzjhQTSrgChULULUadYgQx7jgCZj0VLU1QchQNITgCVkvYLUa6ChQ P_0001_003_00000002 < 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/home/benchmark/working_dir/commits:20706/replica_docking/output/decoys_P_0002_traj.out.oversized 1c1 < File replica_docking/output/decoys_P_0002_traj.out is too large [353,268,085]... Skipping! \ No newline at end of file --- > File replica_docking/output/decoys_P_0002_traj.out is too large [323,557,127]... Skipping! \ No newline at end of file diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/output/scores.fsc /home/benchmark/working_dir/commits:20706/replica_docking/output/scores.fsc 3,4c3,4 < SCORE: -917.819 0.000 -1400.109 381.743 0.000 111.182 -38.164 27.528 2.000 2.000 P_0001_trajP_0001 < SCORE: -1036.325 0.000 -1391.181 254.038 0.000 111.179 -38.097 27.736 3.000 3.000 P_0001_trajP_0001 --- > SCORE: -1045.066 0.000 -1400.109 254.495 0.000 111.182 -38.164 27.528 3.000 3.000 P_0001_trajP_0001 > SCORE: -909.306 0.000 -1391.181 381.056 0.000 111.179 -38.097 27.736 2.000 2.000 P_0001_trajP_0001 6,7d5 < SCORE: -910.855 0.000 -1392.746 381.663 0.000 110.323 -38.125 28.031 2.000 2.000 P_0001_trajP_0001 < SCORE: -1038.261 0.000 -1393.560 254.184 0.000 111.181 -38.026 27.959 3.000 3.000 P_0001_trajP_0001 4561,4999d4558 < SCORE: -1045.019 0.000 -1403.111 244.479 0.000 94.608 -35.446 54.449 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.019 0.000 -1403.111 244.479 0.000 94.608 -35.446 54.449 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.019 0.000 -1403.111 244.479 0.000 94.608 -35.446 54.449 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.019 0.000 -1403.111 244.479 0.000 94.608 -35.446 54.449 1.000 1.000 P_0002_trajP_0002 < SCORE: -1039.971 0.000 -1402.413 247.565 0.000 94.840 -35.231 55.268 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.297 0.000 -1402.139 246.480 0.000 94.771 -35.044 54.634 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.297 0.000 -1402.139 246.480 0.000 94.771 -35.044 54.634 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.297 0.000 -1402.139 246.480 0.000 94.771 -35.044 54.634 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.313 0.000 -1401.887 245.381 0.000 94.581 -35.055 54.667 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.313 0.000 -1401.887 245.381 0.000 94.581 -35.055 54.667 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.125 0.000 -1401.612 245.363 0.000 94.608 -35.059 54.574 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.125 0.000 -1401.612 245.363 0.000 94.608 -35.059 54.574 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.808 0.000 -1401.153 245.148 0.000 94.602 -35.032 54.627 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.808 0.000 -1401.153 245.148 0.000 94.602 -35.032 54.627 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.584 0.000 -1401.223 244.532 0.000 94.925 -35.424 54.605 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.189 0.000 -1400.869 243.623 0.000 94.914 -35.403 54.546 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.124 0.000 -1400.880 243.652 0.000 94.909 -35.388 54.582 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.124 0.000 -1400.880 243.652 0.000 94.909 -35.388 54.582 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.143 0.000 -1400.814 243.472 0.000 94.918 -35.385 54.666 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.141 0.000 -1400.823 243.446 0.000 94.923 -35.374 54.688 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.797 0.000 -1400.859 243.558 0.000 94.920 -35.357 54.941 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.797 0.000 -1400.859 243.558 0.000 94.920 -35.357 54.941 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.797 0.000 -1400.859 243.558 0.000 94.920 -35.357 54.941 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.764 0.000 -1400.850 243.574 0.000 94.940 -35.126 54.698 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.838 0.000 -1400.833 243.485 0.000 94.940 -35.126 54.697 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.535 0.000 -1402.819 244.960 0.000 94.949 -35.159 54.535 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.535 0.000 -1402.819 244.960 0.000 94.949 -35.159 54.535 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.888 0.000 -1403.248 242.775 0.000 95.018 -35.075 54.642 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.273 0.000 -1403.303 242.754 0.000 95.025 -35.144 54.396 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.690 0.000 -1403.286 242.258 0.000 95.012 -35.095 54.421 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.977 0.000 -1403.234 242.136 0.000 94.814 -35.187 54.493 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.315 0.000 -1402.696 241.843 0.000 94.625 -35.301 54.215 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.315 0.000 -1402.697 241.846 0.000 94.625 -35.305 54.215 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.904 0.000 -1402.725 241.274 0.000 94.626 -35.306 54.227 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.925 0.000 -1402.511 240.644 0.000 94.870 -35.210 54.282 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.851 0.000 -1402.908 242.233 0.000 94.795 -35.229 54.257 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.480 0.000 -1403.108 241.750 0.000 94.786 -35.223 54.314 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.480 0.000 -1403.108 241.750 0.000 94.786 -35.223 54.314 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.834 0.000 -1403.462 242.885 0.000 94.847 -35.374 54.270 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.834 0.000 -1403.462 242.885 0.000 94.847 -35.374 54.270 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.417 0.000 -1403.285 242.642 0.000 95.148 -35.563 53.640 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.417 0.000 -1403.285 242.642 0.000 95.148 -35.563 53.640 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.392 0.000 -1403.277 242.583 0.000 95.157 -35.478 53.623 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.668 0.000 -1403.474 242.329 0.000 95.144 -35.479 53.811 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.918 0.000 -1403.789 243.178 0.000 95.114 -35.431 54.010 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.837 0.000 -1403.812 243.238 0.000 95.119 -35.418 54.036 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.837 0.000 -1403.812 243.238 0.000 95.119 -35.418 54.036 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.955 0.000 -1403.541 243.164 0.000 94.862 -35.315 54.875 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.957 0.000 -1403.544 243.155 0.000 94.860 -35.307 54.879 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.934 0.000 -1403.513 243.146 0.000 94.860 -35.296 54.869 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.431 0.000 -1403.734 242.841 0.000 94.860 -35.283 54.885 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.460 0.000 -1403.737 242.813 0.000 94.860 -35.282 54.886 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.460 0.000 -1403.737 242.813 0.000 94.860 -35.282 54.886 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.460 0.000 -1403.737 242.813 0.000 94.860 -35.282 54.886 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.460 0.000 -1403.737 242.813 0.000 94.860 -35.282 54.886 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.703 0.000 -1403.790 242.806 0.000 94.850 -35.350 54.781 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.272 0.000 -1404.261 243.678 0.000 94.868 -35.347 54.789 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.875 0.000 -1404.464 244.014 0.000 94.959 -34.641 55.257 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.900 0.000 -1405.031 243.635 0.000 94.809 -34.547 56.235 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.527 0.000 -1405.019 243.721 0.000 94.802 -34.512 56.482 1.000 1.000 P_0002_trajP_0002 < SCORE: -1043.730 0.000 -1404.236 243.417 0.000 94.800 -34.360 56.649 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.528 0.000 -1405.430 243.736 0.000 94.798 -34.296 56.665 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.248 0.000 -1404.909 243.483 0.000 94.852 -34.270 56.597 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.646 0.000 -1405.908 245.010 0.000 94.833 -33.889 57.308 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.726 0.000 -1405.907 244.932 0.000 94.833 -33.889 57.305 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.036 0.000 -1405.970 245.431 0.000 94.790 -33.682 57.394 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.036 0.000 -1405.970 245.431 0.000 94.790 -33.682 57.394 1.000 1.000 P_0002_trajP_0002 < SCORE: -1042.036 0.000 -1405.970 245.431 0.000 94.790 -33.682 57.394 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.546 0.000 -1405.795 246.430 0.000 94.739 -33.594 57.674 1.000 1.000 P_0002_trajP_0002 < SCORE: -1039.168 0.000 -1406.297 248.189 0.000 95.066 -33.828 57.702 1.000 1.000 P_0002_trajP_0002 < SCORE: -1039.159 0.000 -1406.513 248.528 0.000 95.030 -33.945 57.741 1.000 1.000 P_0002_trajP_0002 < SCORE: -1039.159 0.000 -1406.513 248.528 0.000 95.030 -33.945 57.741 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.779 0.000 -1406.274 248.428 0.000 95.908 -33.659 54.818 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.282 0.000 -1406.836 250.829 0.000 95.818 -33.735 53.641 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.282 0.000 -1406.836 250.829 0.000 95.818 -33.735 53.641 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.072 0.000 -1406.937 251.294 0.000 95.785 -33.823 53.610 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.072 0.000 -1406.937 251.294 0.000 95.785 -33.823 53.610 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.097 0.000 -1406.697 248.639 0.000 95.883 -33.368 54.446 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.193 0.000 -1401.979 243.825 0.000 95.883 -33.368 54.446 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.713 0.000 -1402.540 244.965 0.000 95.845 -33.361 54.378 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.765 0.000 -1402.543 244.866 0.000 95.796 -33.314 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.765 0.000 -1402.543 244.866 0.000 95.796 -33.314 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.765 0.000 -1402.543 244.866 0.000 95.796 -33.314 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.765 0.000 -1402.543 244.866 0.000 95.796 -33.314 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1040.765 0.000 -1402.543 244.866 0.000 95.796 -33.314 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1037.132 0.000 -1404.737 250.674 0.000 95.819 -33.320 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1037.132 0.000 -1404.737 250.674 0.000 95.819 -33.320 54.431 1.000 1.000 P_0002_trajP_0002 < SCORE: -1037.075 0.000 -1404.712 250.680 0.000 95.784 -33.296 54.469 1.000 1.000 P_0002_trajP_0002 < SCORE: -1038.838 0.000 -1406.442 251.469 0.000 95.449 -33.395 54.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1038.838 0.000 -1406.442 251.469 0.000 95.449 -33.395 54.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1038.838 0.000 -1406.442 251.469 0.000 95.449 -33.395 54.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1038.838 0.000 -1406.442 251.469 0.000 95.449 -33.395 54.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1038.664 0.000 -1406.439 251.539 0.000 95.439 -33.228 54.025 1.000 1.000 P_0002_trajP_0002 < SCORE: -1041.909 0.000 -1407.391 249.325 0.000 95.426 -33.313 54.044 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.417 0.000 -1406.803 245.410 0.000 95.710 -33.554 52.821 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.417 0.000 -1406.803 245.410 0.000 95.710 -33.554 52.821 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.507 0.000 -1408.922 251.994 0.000 95.800 -33.999 50.619 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.508 0.000 -1409.255 252.240 0.000 95.872 -33.992 50.627 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.508 0.000 -1409.255 252.240 0.000 95.872 -33.992 50.627 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.854 0.000 -1408.790 251.220 0.000 95.855 -34.142 50.002 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.534 0.000 -1409.072 252.094 0.000 95.891 -34.204 49.758 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.534 0.000 -1409.072 252.094 0.000 95.891 -34.204 49.758 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.534 0.000 -1409.072 252.094 0.000 95.891 -34.204 49.758 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.499 0.000 -1408.445 251.397 0.000 95.884 -34.164 49.829 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.781 0.000 -1404.834 246.503 0.000 95.884 -34.164 49.829 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.781 0.000 -1404.834 246.503 0.000 95.884 -34.164 49.829 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.781 0.000 -1404.834 246.503 0.000 95.884 -34.164 49.829 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.578 0.000 -1404.886 246.580 0.000 95.836 -34.048 49.940 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.578 0.000 -1404.886 246.580 0.000 95.836 -34.048 49.940 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.578 0.000 -1404.886 246.580 0.000 95.836 -34.048 49.940 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.001 0.000 -1404.951 246.310 0.000 95.481 -34.021 50.179 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.014 0.000 -1403.743 243.781 0.000 95.339 -33.864 51.473 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.014 0.000 -1403.743 243.781 0.000 95.339 -33.864 51.473 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.308 0.000 -1403.953 243.768 0.000 95.501 -33.958 51.335 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.569 0.000 -1402.392 243.013 0.000 95.424 -33.861 51.247 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.569 0.000 -1402.392 243.013 0.000 95.424 -33.861 51.247 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.569 0.000 -1402.392 243.013 0.000 95.424 -33.861 51.247 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.272 0.000 -1402.450 243.366 0.000 95.429 -33.834 51.217 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.363 0.000 -1402.380 243.137 0.000 95.439 -33.880 51.321 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.756 0.000 -1401.540 241.877 0.000 95.467 -33.794 51.233 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.255 0.000 -1401.790 241.225 0.000 95.543 -33.953 50.720 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.717 0.000 -1408.854 249.660 0.000 95.484 -33.985 50.978 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.717 0.000 -1408.854 249.660 0.000 95.484 -33.985 50.978 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.717 0.000 -1408.854 249.660 0.000 95.484 -33.985 50.978 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.111 0.000 -1409.147 249.843 0.000 95.546 -34.035 51.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.111 0.000 -1409.147 249.843 0.000 95.546 -34.035 51.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.111 0.000 -1409.147 249.843 0.000 95.546 -34.035 51.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.111 0.000 -1409.147 249.843 0.000 95.546 -34.035 51.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.650 0.000 -1409.159 249.711 0.000 95.591 -34.178 52.385 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.917 0.000 -1409.266 249.422 0.000 95.599 -34.823 52.151 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.152 0.000 -1407.550 250.304 0.000 95.652 -34.866 52.307 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.152 0.000 -1407.550 250.304 0.000 95.652 -34.866 52.307 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.592 0.000 -1406.783 248.075 0.000 95.641 -34.831 52.306 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.592 0.000 -1406.783 248.075 0.000 95.641 -34.831 52.306 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.450 0.000 -1406.819 248.130 0.000 95.615 -34.749 52.372 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.238 0.000 -1406.927 248.353 0.000 95.622 -34.739 52.452 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.224 0.000 -1406.151 248.165 0.000 95.597 -34.489 52.654 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.284 0.000 -1405.191 247.244 0.000 95.630 -34.559 52.592 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.498 0.000 -1405.521 247.580 0.000 95.728 -34.589 52.304 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.803 0.000 -1405.432 247.490 0.000 95.726 -34.666 52.079 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.886 0.000 -1405.072 247.701 0.000 95.683 -34.797 51.599 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.334 0.000 -1405.179 247.830 0.000 95.613 -35.289 50.691 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.985 0.000 -1405.303 248.019 0.000 95.694 -35.077 50.682 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.985 0.000 -1405.303 248.019 0.000 95.694 -35.077 50.682 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.959 0.000 -1403.140 245.869 0.000 95.421 -34.821 49.713 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.243 0.000 -1403.308 245.765 0.000 95.414 -34.821 49.706 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.607 0.000 -1403.065 245.539 0.000 95.580 -34.663 50.002 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.607 0.000 -1403.065 245.539 0.000 95.580 -34.663 50.002 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.607 0.000 -1403.065 245.539 0.000 95.580 -34.663 50.002 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.607 0.000 -1403.065 245.539 0.000 95.580 -34.663 50.002 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.193 0.000 -1402.878 245.259 0.000 95.841 -34.793 50.378 1.000 1.000 P_0002_trajP_0002 < SCORE: -1044.878 0.000 -1403.589 246.470 0.000 95.910 -34.811 51.142 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.633 0.000 -1403.951 246.408 0.000 95.755 -34.771 50.928 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.633 0.000 -1403.951 246.408 0.000 95.755 -34.771 50.928 1.000 1.000 P_0002_trajP_0002 < SCORE: -1045.633 0.000 -1403.951 246.408 0.000 95.755 -34.771 50.928 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.392 0.000 -1403.922 246.641 0.000 95.731 -34.260 49.420 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.392 0.000 -1403.922 246.641 0.000 95.731 -34.260 49.420 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.392 0.000 -1403.922 246.641 0.000 95.731 -34.260 49.420 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.251 0.000 -1404.651 247.304 0.000 95.779 -34.214 49.532 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.949 0.000 -1405.148 246.110 0.000 95.777 -34.075 49.387 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.573 0.000 -1405.491 245.006 0.000 95.640 -34.153 49.426 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.573 0.000 -1405.491 245.006 0.000 95.640 -34.153 49.426 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.724 0.000 -1405.566 244.965 0.000 95.595 -34.048 49.330 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.676 0.000 -1405.455 244.921 0.000 95.587 -34.048 49.319 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.676 0.000 -1405.455 244.921 0.000 95.587 -34.048 49.319 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.676 0.000 -1405.455 244.921 0.000 95.587 -34.048 49.319 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.312 0.000 -1405.190 244.783 0.000 95.644 -34.149 49.599 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.254 0.000 -1406.157 245.671 0.000 95.716 -34.221 49.738 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.212 0.000 -1406.422 246.404 0.000 96.095 -34.933 48.645 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.501 0.000 -1406.745 246.270 0.000 96.100 -34.864 48.739 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.501 0.000 -1406.745 246.270 0.000 96.100 -34.864 48.739 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.752 0.000 -1407.346 246.851 0.000 96.012 -34.874 48.605 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.752 0.000 -1407.346 246.851 0.000 96.012 -34.874 48.605 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.752 0.000 -1407.346 246.851 0.000 96.012 -34.874 48.605 1.000 1.000 P_0002_trajP_0002 < SCORE: -1046.641 0.000 -1411.012 253.175 0.000 96.097 -34.392 49.491 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.999 0.000 -1411.429 252.882 0.000 96.128 -34.390 48.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1047.999 0.000 -1411.429 252.882 0.000 96.128 -34.390 48.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.892 0.000 -1410.259 250.605 0.000 96.145 -34.364 48.981 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.118 0.000 -1409.696 249.686 0.000 96.069 -34.192 49.015 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.118 0.000 -1409.696 249.686 0.000 96.069 -34.192 49.015 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.651 0.000 -1408.291 247.955 0.000 95.960 -33.843 46.568 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.651 0.000 -1408.291 247.955 0.000 95.960 -33.843 46.568 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.373 0.000 -1407.319 248.023 0.000 96.086 -34.307 45.144 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.373 0.000 -1407.319 248.023 0.000 96.086 -34.307 45.144 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.860 0.000 -1407.755 248.659 0.000 96.002 -34.183 45.416 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.860 0.000 -1407.755 248.659 0.000 96.002 -34.183 45.416 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.860 0.000 -1407.755 248.659 0.000 96.002 -34.183 45.416 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.199 0.000 -1400.086 243.651 0.000 96.002 -34.183 45.416 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.199 0.000 -1400.086 243.651 0.000 96.002 -34.183 45.416 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.082 0.000 -1399.418 239.799 0.000 96.079 -34.715 45.174 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.302 0.000 -1399.276 238.439 0.000 96.078 -34.695 45.152 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.074 0.000 -1401.274 240.713 0.000 96.076 -34.671 45.083 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.134 0.000 -1401.261 240.642 0.000 96.073 -34.668 45.080 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.134 0.000 -1401.261 240.642 0.000 96.073 -34.668 45.080 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.134 0.000 -1401.261 240.642 0.000 96.073 -34.668 45.080 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.304 0.000 -1399.480 239.829 0.000 96.162 -34.786 44.971 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.300 0.000 -1400.454 242.866 0.000 96.210 -34.441 44.519 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.436 0.000 -1398.336 240.137 0.000 96.311 -34.290 44.742 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.436 0.000 -1398.336 240.137 0.000 96.311 -34.290 44.742 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.619 0.000 -1398.892 240.522 0.000 96.305 -34.286 44.733 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.528 0.000 -1398.950 240.750 0.000 96.293 -34.303 44.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.528 0.000 -1398.950 240.750 0.000 96.293 -34.303 44.683 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.856 0.000 -1398.867 242.485 0.000 96.291 -34.319 44.555 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.856 0.000 -1398.867 242.485 0.000 96.291 -34.319 44.555 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.906 0.000 -1398.744 242.631 0.000 96.527 -34.271 43.951 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.160 0.000 -1402.121 244.754 0.000 96.527 -34.271 43.951 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.160 0.000 -1402.121 244.754 0.000 96.527 -34.271 43.951 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.160 0.000 -1402.121 244.754 0.000 96.527 -34.271 43.951 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.160 0.000 -1402.121 244.754 0.000 96.527 -34.271 43.951 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.173 0.000 -1402.149 244.761 0.000 96.528 -34.270 43.957 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.173 0.000 -1402.149 244.761 0.000 96.528 -34.270 43.957 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.217 0.000 -1403.281 247.472 0.000 96.676 -33.535 43.451 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.975 0.000 -1403.759 248.209 0.000 96.663 -33.529 43.441 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.508 0.000 -1403.241 248.906 0.000 96.532 -34.172 43.466 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.508 0.000 -1403.241 248.906 0.000 96.532 -34.172 43.466 1.000 1.000 P_0002_trajP_0002 < SCORE: -1048.531 0.000 -1403.299 249.349 0.000 96.237 -34.298 43.480 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.773 0.000 -1402.972 248.486 0.000 96.495 -34.738 42.955 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.563 0.000 -1403.472 247.077 0.000 96.296 -34.950 43.486 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.944 0.000 -1405.358 250.618 0.000 96.455 -35.214 43.554 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.347 0.000 -1405.343 249.756 0.000 96.449 -35.183 43.975 1.000 1.000 P_0002_trajP_0002 < SCORE: -1049.979 0.000 -1404.980 249.729 0.000 96.592 -35.256 43.936 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.095 0.000 -1405.151 247.387 0.000 96.563 -35.179 45.285 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.064 0.000 -1405.138 247.398 0.000 96.564 -35.178 45.291 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.837 0.000 -1405.791 248.170 0.000 96.545 -35.163 45.402 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.158 0.000 -1405.825 248.150 0.000 96.550 -35.219 45.187 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.272 0.000 -1406.857 247.202 0.000 96.512 -35.305 45.177 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.825 0.000 -1406.978 247.186 0.000 96.658 -35.583 44.893 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.097 0.000 -1406.984 247.397 0.000 97.133 -35.447 45.804 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.154 0.000 -1406.089 246.184 0.000 97.075 -35.448 46.124 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.154 0.000 -1406.089 246.184 0.000 97.075 -35.448 46.124 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.154 0.000 -1406.089 246.184 0.000 97.075 -35.448 46.124 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.933 0.000 -1406.744 246.143 0.000 97.065 -35.459 46.062 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.933 0.000 -1406.744 246.143 0.000 97.065 -35.459 46.062 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.933 0.000 -1406.744 246.143 0.000 97.065 -35.459 46.062 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.933 0.000 -1406.744 246.143 0.000 97.065 -35.459 46.062 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.569 0.000 -1407.214 247.003 0.000 97.398 -35.408 46.652 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.365 0.000 -1407.210 247.078 0.000 97.141 -35.255 46.882 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.066 0.000 -1408.871 248.615 0.000 97.086 -35.736 46.841 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.218 0.000 -1408.751 248.291 0.000 97.086 -35.729 46.886 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.229 0.000 -1408.928 248.824 0.000 97.114 -35.790 46.550 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.800 0.000 -1408.787 249.160 0.000 97.210 -35.805 46.422 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.800 0.000 -1408.787 249.160 0.000 97.210 -35.805 46.422 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.474 0.000 -1408.806 248.781 0.000 97.160 -36.016 45.407 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.502 0.000 -1410.007 248.894 0.000 96.791 -36.011 44.830 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.502 0.000 -1410.007 248.894 0.000 96.791 -36.011 44.830 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.502 0.000 -1410.007 248.894 0.000 96.791 -36.011 44.830 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.244 0.000 -1410.058 249.282 0.000 96.789 -36.035 44.777 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.487 0.000 -1410.151 249.263 0.000 96.760 -35.989 44.631 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.931 0.000 -1410.268 251.112 0.000 96.786 -36.155 44.595 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.164 0.000 -1411.863 251.090 0.000 96.893 -36.032 44.749 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.164 0.000 -1411.863 251.090 0.000 96.893 -36.032 44.749 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.283 0.000 -1411.787 251.214 0.000 96.987 -36.172 44.476 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.283 0.000 -1411.787 251.214 0.000 96.987 -36.172 44.476 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.406 0.000 -1412.131 251.868 0.000 96.808 -36.323 45.373 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.479 0.000 -1411.759 251.384 0.000 96.811 -36.314 45.400 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.479 0.000 -1411.759 251.384 0.000 96.811 -36.314 45.400 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.479 0.000 -1411.759 251.384 0.000 96.811 -36.314 45.400 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.479 0.000 -1411.759 251.384 0.000 96.811 -36.314 45.400 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.971 0.000 -1411.924 251.375 0.000 96.742 -36.394 45.231 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.971 0.000 -1411.924 251.375 0.000 96.742 -36.394 45.231 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.895 0.000 -1411.590 251.824 0.000 96.764 -36.371 45.477 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.620 0.000 -1411.384 252.068 0.000 96.851 -36.335 45.180 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.024 0.000 -1410.844 251.894 0.000 96.814 -36.310 45.422 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.024 0.000 -1410.844 251.894 0.000 96.814 -36.310 45.422 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.024 0.000 -1410.844 251.894 0.000 96.814 -36.310 45.422 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.643 0.000 -1410.971 252.126 0.000 96.764 -36.217 45.656 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.643 0.000 -1410.971 252.126 0.000 96.764 -36.217 45.656 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.643 0.000 -1410.971 252.126 0.000 96.764 -36.217 45.656 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.444 0.000 -1410.463 252.014 0.000 96.802 -36.253 45.457 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.444 0.000 -1410.463 252.014 0.000 96.802 -36.253 45.457 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.925 0.000 -1410.224 251.624 0.000 96.734 -36.222 45.164 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.252 0.000 -1409.839 250.892 0.000 96.753 -36.031 45.974 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.252 0.000 -1409.839 250.892 0.000 96.753 -36.031 45.974 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.252 0.000 -1409.839 250.892 0.000 96.753 -36.031 45.974 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.252 0.000 -1409.839 250.892 0.000 96.753 -36.031 45.974 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.127 0.000 -1409.766 249.060 0.000 96.708 -35.952 45.824 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.127 0.000 -1409.766 249.060 0.000 96.708 -35.952 45.824 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.043 0.000 -1409.817 249.196 0.000 96.699 -35.952 45.832 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.043 0.000 -1409.817 249.196 0.000 96.699 -35.952 45.832 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.286 0.000 -1410.056 249.643 0.000 96.803 -35.972 46.297 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.286 0.000 -1410.056 249.643 0.000 96.803 -35.972 46.297 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.524 0.000 -1409.435 249.636 0.000 96.870 -35.894 46.299 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.433 0.000 -1410.801 249.931 0.000 96.699 -36.080 46.818 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.433 0.000 -1410.801 249.931 0.000 96.699 -36.080 46.818 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.433 0.000 -1410.801 249.931 0.000 96.699 -36.080 46.818 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.433 0.000 -1410.801 249.931 0.000 96.699 -36.080 46.818 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.344 0.000 -1410.824 250.038 0.000 96.696 -36.076 46.822 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.344 0.000 -1410.824 250.038 0.000 96.696 -36.076 46.822 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.359 0.000 -1410.909 248.910 0.000 96.846 -36.087 46.880 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.359 0.000 -1410.909 248.910 0.000 96.846 -36.087 46.880 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.359 0.000 -1410.909 248.910 0.000 96.846 -36.087 46.880 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.953 0.000 -1409.567 248.114 0.000 96.918 -36.312 44.894 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.180 0.000 -1410.158 249.020 0.000 96.857 -36.216 45.317 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.347 0.000 -1410.246 249.045 0.000 96.893 -36.342 45.304 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.880 0.000 -1410.086 248.435 0.000 96.906 -35.961 44.827 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.338 0.000 -1408.315 246.118 0.000 96.966 -35.973 44.867 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.205 0.000 -1409.007 246.976 0.000 96.964 -35.982 44.844 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.205 0.000 -1409.007 246.976 0.000 96.964 -35.982 44.844 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.205 0.000 -1409.007 246.976 0.000 96.964 -35.982 44.844 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.546 0.000 -1409.096 246.999 0.000 97.345 -35.500 45.706 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.546 0.000 -1409.096 246.999 0.000 97.345 -35.500 45.706 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.242 0.000 -1409.031 245.964 0.000 97.318 -35.279 45.786 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.242 0.000 -1409.031 245.964 0.000 97.318 -35.279 45.786 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.830 0.000 -1409.844 246.493 0.000 97.281 -35.282 46.522 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.830 0.000 -1409.844 246.493 0.000 97.281 -35.282 46.522 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.830 0.000 -1409.844 246.493 0.000 97.281 -35.282 46.522 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.282 0.000 -1409.679 246.825 0.000 97.284 -35.255 46.542 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.403 0.000 -1408.995 246.849 0.000 97.268 -35.070 46.544 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.403 0.000 -1408.995 246.849 0.000 97.268 -35.070 46.544 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.403 0.000 -1408.995 246.849 0.000 97.268 -35.070 46.544 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.403 0.000 -1408.995 246.849 0.000 97.268 -35.070 46.544 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.310 0.000 -1409.187 246.118 0.000 97.167 -34.475 47.066 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.243 0.000 -1408.259 245.346 0.000 97.192 -34.499 46.978 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.379 0.000 -1408.162 245.109 0.000 97.154 -34.552 47.073 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.379 0.000 -1408.162 245.109 0.000 97.154 -34.552 47.073 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.461 0.000 -1408.228 245.164 0.000 97.202 -34.666 47.067 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.396 0.000 -1409.413 246.089 0.000 97.308 -34.662 47.282 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.824 0.000 -1409.372 245.737 0.000 97.280 -34.722 47.252 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.841 0.000 -1409.698 246.117 0.000 97.228 -34.999 47.511 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.901 0.000 -1410.199 245.746 0.000 97.218 -35.287 47.620 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.180 0.000 -1410.007 243.400 0.000 97.373 -35.200 48.254 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.332 0.000 -1409.283 242.622 0.000 97.321 -35.090 48.097 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.247 0.000 -1409.260 242.708 0.000 97.311 -35.095 48.090 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.491 0.000 -1409.309 242.711 0.000 97.304 -35.207 48.010 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.765 0.000 -1409.180 242.577 0.000 97.193 -35.215 47.860 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.765 0.000 -1409.180 242.577 0.000 97.193 -35.215 47.860 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.122 0.000 -1409.140 242.362 0.000 97.264 -35.150 47.541 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.122 0.000 -1409.140 242.362 0.000 97.264 -35.150 47.541 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.037 0.000 -1409.390 243.082 0.000 97.020 -35.120 47.371 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.037 0.000 -1409.390 243.082 0.000 97.020 -35.120 47.371 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.037 0.000 -1409.390 243.082 0.000 97.020 -35.120 47.371 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.721 0.000 -1409.337 243.061 0.000 97.046 -34.942 47.452 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.721 0.000 -1409.337 243.061 0.000 97.046 -34.942 47.452 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.721 0.000 -1409.337 243.061 0.000 97.046 -34.942 47.452 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.785 0.000 -1409.452 242.579 0.000 97.090 -35.018 47.016 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.549 0.000 -1409.550 242.873 0.000 97.083 -34.998 47.043 1.000 1.000 P_0002_trajP_0002 < SCORE: -1058.016 0.000 -1409.794 242.994 0.000 97.264 -35.696 47.216 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.060 0.000 -1410.032 244.161 0.000 97.265 -35.689 47.235 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.060 0.000 -1410.032 244.161 0.000 97.265 -35.689 47.235 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.060 0.000 -1410.032 244.161 0.000 97.265 -35.689 47.235 1.000 1.000 P_0002_trajP_0002 < SCORE: -1058.612 0.000 -1410.636 243.086 0.000 97.263 -35.671 47.346 1.000 1.000 P_0002_trajP_0002 < SCORE: -1058.612 0.000 -1410.636 243.086 0.000 97.263 -35.671 47.346 1.000 1.000 P_0002_trajP_0002 < SCORE: -1058.612 0.000 -1410.636 243.086 0.000 97.263 -35.671 47.346 1.000 1.000 P_0002_trajP_0002 < SCORE: -1058.942 0.000 -1410.760 243.160 0.000 97.150 -35.676 47.183 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.231 0.000 -1410.624 245.881 0.000 97.147 -35.745 47.111 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.552 0.000 -1410.535 245.546 0.000 97.157 -35.718 46.998 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.386 0.000 -1411.119 246.125 0.000 97.359 -35.631 46.881 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.120 0.000 -1411.142 246.714 0.000 97.334 -35.712 46.684 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.120 0.000 -1411.142 246.714 0.000 97.334 -35.712 46.684 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.120 0.000 -1411.142 246.714 0.000 97.334 -35.712 46.684 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.120 0.000 -1411.142 246.714 0.000 97.334 -35.712 46.684 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.854 0.000 -1411.210 247.065 0.000 97.360 -35.712 46.643 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.854 0.000 -1411.210 247.065 0.000 97.360 -35.712 46.643 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.854 0.000 -1411.210 247.065 0.000 97.360 -35.712 46.643 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.854 0.000 -1411.210 247.065 0.000 97.360 -35.712 46.643 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.854 0.000 -1411.210 247.065 0.000 97.360 -35.712 46.643 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.643 0.000 -1411.223 246.489 0.000 97.365 -35.771 46.497 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.643 0.000 -1411.223 246.489 0.000 97.365 -35.771 46.497 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.314 0.000 -1411.381 246.306 0.000 97.345 -35.849 46.265 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.314 0.000 -1411.381 246.306 0.000 97.345 -35.849 46.265 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.314 0.000 -1411.381 246.305 0.000 97.346 -35.849 46.265 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.314 0.000 -1411.381 246.305 0.000 97.346 -35.849 46.265 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.897 0.000 -1410.782 245.680 0.000 97.602 -35.733 46.336 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.853 0.000 -1410.813 245.753 0.000 97.607 -35.737 46.337 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.624 0.000 -1410.869 246.033 0.000 97.574 -35.700 46.339 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.676 0.000 -1410.982 246.093 0.000 97.576 -35.705 46.342 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.994 0.000 -1410.957 245.738 0.000 97.569 -35.683 46.339 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.633 0.000 -1411.078 246.974 0.000 97.618 -35.636 46.489 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.633 0.000 -1411.078 246.974 0.000 97.618 -35.636 46.489 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.633 0.000 -1411.078 246.974 0.000 97.618 -35.636 46.489 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.725 0.000 -1411.265 246.987 0.000 97.608 -35.558 46.502 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.725 0.000 -1411.265 246.987 0.000 97.608 -35.558 46.502 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.725 0.000 -1411.265 246.987 0.000 97.608 -35.558 46.502 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.690 0.000 -1411.236 247.004 0.000 97.607 -35.559 46.495 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.690 0.000 -1411.236 247.004 0.000 97.607 -35.559 46.495 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.183 0.000 -1410.470 246.939 0.000 97.209 -35.941 45.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.183 0.000 -1410.470 246.939 0.000 97.209 -35.941 45.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.183 0.000 -1410.470 246.939 0.000 97.209 -35.941 45.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.183 0.000 -1410.470 246.939 0.000 97.209 -35.941 45.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.183 0.000 -1410.470 246.939 0.000 97.209 -35.941 45.081 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.173 0.000 -1410.351 246.836 0.000 97.216 -35.953 45.078 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.173 0.000 -1410.351 246.836 0.000 97.216 -35.953 45.078 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.173 0.000 -1410.351 246.836 0.000 97.216 -35.953 45.078 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.866 0.000 -1409.681 246.704 0.000 97.245 -36.030 44.895 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.861 0.000 -1409.663 246.664 0.000 97.277 -36.052 44.912 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.452 0.000 -1412.978 249.364 0.000 97.275 -36.031 44.918 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.660 0.000 -1413.107 249.978 0.000 97.244 -35.853 45.077 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.753 0.000 -1414.442 250.149 0.000 97.113 -36.093 45.521 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.430 0.000 -1414.362 250.407 0.000 97.150 -36.058 45.433 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.430 0.000 -1414.362 250.407 0.000 97.150 -36.058 45.433 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.339 0.000 -1414.289 250.234 0.000 97.027 -36.298 45.987 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.339 0.000 -1414.289 250.234 0.000 97.027 -36.298 45.987 1.000 1.000 P_0002_trajP_0002 < SCORE: -1057.664 0.000 -1414.449 250.135 0.000 97.008 -36.296 45.938 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.317 0.000 -1415.205 251.505 0.000 97.131 -36.240 46.492 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.776 0.000 -1415.410 252.209 0.000 97.146 -36.234 46.514 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.836 0.000 -1414.967 251.653 0.000 97.155 -36.259 46.581 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.311 0.000 -1414.258 251.316 0.000 97.488 -36.341 45.485 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.316 0.000 -1414.258 251.318 0.000 97.487 -36.343 45.481 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.121 0.000 -1414.363 251.556 0.000 97.475 -36.336 45.547 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.121 0.000 -1414.363 251.556 0.000 97.475 -36.336 45.547 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.932 0.000 -1414.562 250.879 0.000 97.475 -36.314 45.589 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.932 0.000 -1414.562 250.879 0.000 97.475 -36.314 45.589 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.176 0.000 -1414.578 251.714 0.000 97.539 -36.333 45.483 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.176 0.000 -1414.578 251.714 0.000 97.539 -36.333 45.483 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.181 0.000 -1414.581 251.687 0.000 97.539 -36.325 45.499 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.181 0.000 -1414.581 251.687 0.000 97.539 -36.325 45.499 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.259 0.000 -1414.499 251.506 0.000 97.541 -36.311 45.504 1.000 1.000 P_0002_trajP_0002 < SCORE: -1056.259 0.000 -1414.499 251.506 0.000 97.541 -36.311 45.504 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.175 0.000 -1414.519 252.145 0.000 97.585 -36.171 45.784 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.175 0.000 -1414.519 252.145 0.000 97.585 -36.171 45.784 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.175 0.000 -1414.519 252.145 0.000 97.585 -36.171 45.784 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.175 0.000 -1414.519 252.145 0.000 97.585 -36.171 45.784 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.175 0.000 -1414.519 252.145 0.000 97.585 -36.171 45.784 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.290 0.000 -1414.943 252.749 0.000 97.474 -36.264 45.694 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.290 0.000 -1414.943 252.749 0.000 97.474 -36.264 45.694 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.658 0.000 -1414.283 251.701 0.000 97.537 -36.299 45.685 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.658 0.000 -1414.283 251.701 0.000 97.537 -36.299 45.685 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.658 0.000 -1414.283 251.701 0.000 97.537 -36.299 45.685 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.658 0.000 -1414.283 251.701 0.000 97.537 -36.299 45.685 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.488 0.000 -1414.393 253.066 0.000 97.200 -36.248 44.887 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.498 0.000 -1414.390 253.054 0.000 97.200 -36.247 44.885 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.325 0.000 -1414.355 252.870 0.000 97.275 -36.280 45.165 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.325 0.000 -1414.355 252.870 0.000 97.275 -36.280 45.165 1.000 1.000 P_0002_trajP_0002 < SCORE: -1055.325 0.000 -1414.355 252.870 0.000 97.275 -36.280 45.165 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.219 0.000 -1413.480 252.210 0.000 97.384 -36.143 45.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.219 0.000 -1413.480 252.210 0.000 97.384 -36.143 45.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1054.219 0.000 -1413.480 252.210 0.000 97.384 -36.143 45.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1052.464 0.000 -1407.174 247.659 0.000 97.384 -36.143 45.809 1.000 1.000 P_0002_trajP_0002 < SCORE: -1053.803 0.000 -1408.340 247.052 0.000 97.224 -35.984 46.245 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.325 0.000 -1407.869 248.823 0.000 97.246 -35.519 45.994 1.000 1.000 P_0002_trajP_0002 < SCORE: -1051.325 0.000 -1407.869 248.823 0.000 97.246 -35.519 45.994 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.944 0.000 -1405.398 247.166 0.000 97.622 -35.694 45.360 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.923 0.000 -1405.435 247.160 0.000 97.622 -35.710 45.440 1.000 1.000 P_0002_trajP_0002 < SCORE: -1050.320 0.000 -1405.732 248.379 0.000 97.678 -35.761 45.115 1.000 1.000 P_0002_trajP_0002 diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/tempering.stats /home/benchmark/working_dir/commits:20706/replica_docking/tempering.stats 3c3 < level 2 temperature 2.00 HX_2_3 trials= 1 NO ACCEPTS. --- > level 2 temperature 2.00 HX_2_3 trials= 1; accepts= 1.0000; 5c5 < level 3 temperature 3.00 HX_3_2 trials= 1 NO ACCEPTS. --- > level 3 temperature 3.00 HX_3_2 trials= 1; accepts= 1.0000; diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/.test_got_timeout_kill.log /home/benchmark/working_dir/commits:20706/replica_docking/.test_got_timeout_kill.log 1c1 < *** Test replica_docking exceeded the timeout=7200.0 and will be killed! [2025-03-24 18:16:32.601688] --- > *** Test replica_docking exceeded the timeout=7200.0 and will be killed! [2025-04-01 19:28:21.528135] diff -r '--exclude=command.sh' '--exclude=command.mpi.sh' '--exclude=observers' '--exclude=*.ignore' /home/benchmark/working_dir/main:62149/replica_docking/trial.stats /home/benchmark/working_dir/commits:20706/replica_docking/trial.stats 12,21c12,27 < level 2 temperature 2.00 RigidBodyPerturb trials= 16; accepts= 0.4375; < level 2 temperature 2.00 br_CA_CA_04 trials= 5; accepts= 0.2000; < level 2 temperature 2.00 br_CA_CA_07 trials= 5; accepts= 0.2000; < level 2 temperature 2.00 br_CA_CA_10 trials= 2 NO ACCEPTS. < level 2 temperature 2.00 br_CA_CA_13 trials= 1; accepts= 1.0000; < level 2 temperature 2.00 br_CA_CA_19 trials= 2; accepts= 1.0000; < level 2 temperature 2.00 br_CA_CA_25 trials= 2; accepts= 1.0000; < level 2 temperature 2.00 br_CA_CA_28 trials= 1; accepts= 1.0000; < level 2 temperature 2.00 br_CA_CA_31 trials= 4; accepts= 1.0000; < level 2 temperature 2.00 br_CA_CA_34 trials= 2; accepts= 1.0000; --- > level 2 temperature 2.00 RigidBodyPerturb trials= 9; accepts= 0.1111; > level 2 temperature 2.00 br_CA_CA_04 trials= 1 NO ACCEPTS. > level 2 temperature 2.00 br_CA_CA_07 trials= 2; accepts= 0.5000; > level 2 temperature 2.00 br_CA_CA_10 trials= 1 NO ACCEPTS. > level 2 temperature 2.00 br_CA_CA_25 trials= 3; accepts= 1.0000; > level 2 temperature 2.00 br_CA_CA_31 trials= 2; accepts= 1.0000; > level 2 temperature 2.00 br_CA_CA_34 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 RigidBodyPerturb trials= 6; accepts= 0.5000; > level 3 temperature 3.00 br_CA_CA_04 trials= 2; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_07 trials= 2; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_10 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_16 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_22 trials= 2; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_25 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_28 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_34 trials= 3; accepts= 1.0000; 23,30c29,40 < level 3 temperature 3.00 RigidBodyPerturb trials= 18; accepts= 0.6111; < level 3 temperature 3.00 br_CA_CA_04 trials= 3 NO ACCEPTS. < level 3 temperature 3.00 br_CA_CA_07 trials= 5; accepts= 0.4000; < level 3 temperature 3.00 br_CA_CA_13 trials= 2; accepts= 1.0000; < level 3 temperature 3.00 br_CA_CA_16 trials= 2; accepts= 1.0000; < level 3 temperature 3.00 br_CA_CA_19 trials= 2; accepts= 1.0000; < level 3 temperature 3.00 br_CA_CA_22 trials= 1; accepts= 1.0000; < level 3 temperature 3.00 br_CA_CA_25 trials= 3; accepts= 1.0000; --- > level 2 temperature 2.00 RigidBodyPerturb trials= 6; accepts= 0.6667; > level 2 temperature 2.00 br_CA_CA_04 trials= 1 NO ACCEPTS. > level 2 temperature 2.00 br_CA_CA_07 trials= 1; accepts= 1.0000; > level 2 temperature 2.00 br_CA_CA_22 trials= 1; accepts= 1.0000; > level 2 temperature 2.00 br_CA_CA_31 trials= 1; accepts= 1.0000; > level 2 temperature 2.00 br_CA_CA_34 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 RigidBodyPerturb trials= 3; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_04 trials= 1 NO ACCEPTS. > level 3 temperature 3.00 br_CA_CA_07 trials= 2 NO ACCEPTS. > level 3 temperature 3.00 br_CA_CA_13 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_16 trials= 1; accepts= 1.0000; > level 3 temperature 3.00 br_CA_CA_25 trials= 1; accepts= 1.0000; 32,33c42 < level 3 temperature 3.00 br_CA_CA_31 trials= 1; accepts= 1.0000; < level 3 temperature 3.00 br_CA_CA_34 trials= 2; accepts= 1.0000; --- > level 3 temperature 3.00 br_CA_CA_34 trials= 1; accepts= 1.0000; Compare(...): Marking as "Script failed" due to presense of .test_did_not_run.log or .test_got_timeout_kill.log file!