data_2lz5_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lz5 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.579 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t . . . . . 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.44 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.579 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.465 ' HG ' ' SG ' ' A' ' 16' ' ' CYS . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.427 ' HG ' ' SG ' ' A' ' 16' ' ' CYS . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.427 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m . . . . . 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.5 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.1 m-70 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t . . . . . 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.45 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.524 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.45 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 98.8 m-70 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t . . . . . 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.217 -0.652 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.477 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.459 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-70 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.459 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.215 -0.738 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 92.2 m-70 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.441 -0.882 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.486 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.6 m-70 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 12' ' ' HIS . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.51 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 96.5 m-70 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.411 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 92.2 m-70 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m . . . . . 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.713 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t . . . . . 0 CA--C 1.509 -0.597 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.535 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.535 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.471 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.0 m-70 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 CA--C 1.502 -0.888 0 CA-C-O 121.214 0.53 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.436 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 93.8 m-70 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.418 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m . . . . . 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.4 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.502 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.8 m-70 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.434 -1.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.4 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 82.8 m-70 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t . . . . . 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 95.9 m-70 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 60.0 m . . . . . 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t . . . . . 0 C--O 1.217 -0.632 0 CA-C-O 121.844 0.83 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.403 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.462 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 95.1 m-70 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.216 -0.682 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.515 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.1 m-70 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m . . . . . 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.579 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t -62.46 -52.52 63.21 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 -177.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.579 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.465 ' HG ' ' SG ' ' A' ' 16' ' ' CYS . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m -122.01 89.92 3.21 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.19 0 O-C-N 122.213 -0.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.043 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t -121.71 -39.71 2.61 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.427 ' HG ' ' SG ' ' A' ' 16' ' ' CYS . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.427 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m -103.84 89.33 3.28 Favored 'General case' 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 116.24 -0.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.469 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t -65.95 -42.43 89.99 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 -178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.5 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.1 m-70 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m -115.6 91.21 3.53 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.586 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t -71.18 -29.02 64.66 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 -177.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.524 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.45 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 98.8 m-70 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t -138.54 -81.75 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.951 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.725 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t -76.95 -32.14 57.1 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.477 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.459 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-70 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.459 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 58.2 m -89.19 94.71 10.02 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.82 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t -82.66 -34.06 27.55 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.56 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 92.2 m-70 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -150.32 -74.85 0.16 Allowed 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.006 0 O-C-N 122.005 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.6 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.64 -35.36 9.52 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.486 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.6 m-70 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 12' ' ' HIS . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.4 m -101.13 100.37 10.93 Favored 'General case' 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.413 0 O-C-N 122.2 -0.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -1.245 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t -62.89 -50.17 71.95 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 -175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.51 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 96.5 m-70 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t -146.38 -63.22 0.31 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 O-C-N 122.147 -0.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.774 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t -85.27 -31.15 23.25 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.411 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 92.2 m-70 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m -127.63 93.25 3.66 Favored 'General case' 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.342 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -80.2 -29.8 38.63 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.713 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t -134.85 -76.34 0.46 Allowed 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.048 0 O-C-N 122.224 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.354 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t -78.51 -50.03 12.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.535 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.535 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.471 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.0 m-70 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.478 ' HA ' ' N ' ' A' ' 17' ' ' NH2 . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m -102.88 -77.52 0.56 Allowed 'General case' 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . 0.478 ' N ' ' HA ' ' A' ' 13' ' ' PRO . . . . . . . . 0 C--N 1.319 -0.733 0 O-C-N 122.095 -0.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.439 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t -67.46 -50.8 57.53 Favored 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.199 0.6 . . . . 0.0 111.456 -176.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.436 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 93.8 m-70 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.418 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m -106.22 84.06 1.98 Allowed 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 O-C-N 122.25 -0.281 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.937 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t -61.76 -40.41 95.05 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -136.72 -63.16 0.63 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.585 0 O-C-N 120.599 -1.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.384 0 N-CA-C 111.653 -0.579 . . . . 0.0 111.653 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -72.73 -28.95 62.96 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -149.5 91.5 1.83 Allowed 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.17 0 CA-C-N 116.276 -0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.995 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t -71.39 -38.5 71.48 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 -178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.4 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.502 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.8 m-70 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t -142.88 92.37 2.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.411 0 CA-C-N 116.057 -0.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.037 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t -110.85 -57.88 2.17 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.353 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.4 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 82.8 m-70 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t -140.82 -79.18 0.28 Allowed 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.625 0 O-C-N 122.219 -0.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.489 0 N-CA-C 110.196 -1.162 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t -80.95 -34.23 33.35 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 -173.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 95.9 m-70 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 60.0 m -100.91 -87.89 0.38 Allowed 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.917 0 O-C-N 121.682 -0.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.722 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t -64.47 -39.17 93.31 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.039 0.936 . . . . 0.0 111.226 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.403 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.462 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 95.1 m-70 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t -123.92 91.35 3.44 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.128 0 CA-C-N 116.238 -0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.588 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t -72.22 -39.23 68.68 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m -90.9 89.93 7.68 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.137 0 CA-C-N 116.28 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.825 0 N-CA-C 110.191 -1.163 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t -84.42 -41.45 16.65 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.515 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.1 m-70 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m -96.09 88.44 4.85 Favored 'General case' 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.141 0 CA-C-N 116.355 -0.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t . . . . . 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.435 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.52 ' HB3' HD21 ' A' ' 15' ' ' LEU . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.601 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m . . . . . 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 13' ' ' PRO . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.498 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 69.6 m80 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t . . . . . 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t . . . . . 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.217 -0.652 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.472 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.472 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.449 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 67.9 m80 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 58.2 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.215 -0.738 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.441 -0.882 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 11' ' ' LYS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.462 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 69.2 m80 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.55 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 84.4 m . . . . . 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 56.6 m80 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 68.9 m80 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m . . . . . 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.718 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.718 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.566 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t . . . . . 0 CA--C 1.509 -0.597 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.545 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.441 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.545 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 CA--C 1.502 -0.888 0 CA-C-O 121.214 0.53 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m . . . . . 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.446 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.425 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 70.1 m80 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.434 -1.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.449 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t . . . . . 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.0 m . . . . . 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t . . . . . 0 C--O 1.217 -0.632 0 CA-C-O 121.844 0.83 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.422 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.413 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' HD21 ' A' ' 15' ' ' LEU . 74.6 m80 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.216 -0.682 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.518 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.553 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m . . . . . 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t -62.46 -52.52 63.21 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 -177.047 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.435 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.52 ' HB3' HD21 ' A' ' 15' ' ' LEU . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m -122.01 89.92 3.21 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.19 0 O-C-N 122.213 -0.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.043 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t -121.71 -39.71 2.61 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.601 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m -103.84 89.33 3.28 Favored 'General case' 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 116.24 -0.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.469 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t -65.95 -42.43 89.99 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 -178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 13' ' ' PRO . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.498 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 69.6 m80 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m -115.6 91.21 3.53 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.586 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t -71.18 -29.02 64.66 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 -177.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t -138.54 -81.75 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.951 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.725 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t -76.95 -32.14 57.1 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.472 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.472 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.449 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 67.9 m80 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 58.2 m -89.19 94.71 10.02 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.82 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t -82.66 -34.06 27.55 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -150.32 -74.85 0.16 Allowed 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.006 0 O-C-N 122.005 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.6 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.64 -35.36 9.52 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 11' ' ' LYS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.462 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 69.2 m80 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.55 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 84.4 m -101.13 100.37 10.93 Favored 'General case' 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.413 0 O-C-N 122.2 -0.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -1.245 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t -62.89 -50.17 71.95 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 -175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 56.6 m80 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t -146.38 -63.22 0.31 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 O-C-N 122.147 -0.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.774 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t -85.27 -31.15 23.25 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 68.9 m80 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m -127.63 93.25 3.66 Favored 'General case' 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.342 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -80.2 -29.8 38.63 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.718 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.718 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t -134.85 -76.34 0.46 Allowed 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.048 0 O-C-N 122.224 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.354 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.566 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t -78.51 -50.03 12.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.545 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.441 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.545 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HA ' ' N ' ' A' ' 17' ' ' NH2 . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m -102.88 -77.52 0.56 Allowed 'General case' 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . 0.501 ' N ' ' HA ' ' A' ' 13' ' ' PRO . . . . . . . . 0 C--N 1.319 -0.733 0 O-C-N 122.095 -0.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.439 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t -67.46 -50.8 57.53 Favored 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.199 0.6 . . . . 0.0 111.456 -176.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m -106.22 84.06 1.98 Allowed 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 O-C-N 122.25 -0.281 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.937 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t -61.76 -40.41 95.05 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -136.72 -63.16 0.63 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.585 0 O-C-N 120.599 -1.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.384 0 N-CA-C 111.653 -0.579 . . . . 0.0 111.653 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -72.73 -28.95 62.96 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.446 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -149.5 91.5 1.83 Allowed 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.17 0 CA-C-N 116.276 -0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.995 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t -71.39 -38.5 71.48 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 -178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.425 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 70.1 m80 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t -142.88 92.37 2.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.411 0 CA-C-N 116.057 -0.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.037 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t -110.85 -57.88 2.17 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.353 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.449 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t -140.82 -79.18 0.28 Allowed 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.625 0 O-C-N 122.219 -0.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.489 0 N-CA-C 110.196 -1.162 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t -80.95 -34.23 33.35 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 -173.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.0 m -100.91 -87.89 0.38 Allowed 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.917 0 O-C-N 121.682 -0.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.722 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t -64.47 -39.17 93.31 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.039 0.936 . . . . 0.0 111.226 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.422 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.413 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t -123.92 91.35 3.44 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.128 0 CA-C-N 116.238 -0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.588 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t -72.22 -39.23 68.68 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' HD21 ' A' ' 15' ' ' LEU . 74.6 m80 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m -90.9 89.93 7.68 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.137 0 CA-C-N 116.28 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.825 0 N-CA-C 110.191 -1.163 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t -84.42 -41.45 16.65 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.518 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.553 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m -96.09 88.44 4.85 Favored 'General case' 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.141 0 CA-C-N 116.355 -0.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t . . . . . 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.435 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.52 ' HB3' HD21 ' A' ' 15' ' ' LEU . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.601 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m . . . . . 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 13' ' ' PRO . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.498 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.1 m-70 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t . . . . . 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.429 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 98.8 m-70 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t . . . . . 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 C--O 1.217 -0.652 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.472 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.472 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.449 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-70 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 58.2 m . . . . . 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.215 -0.738 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.545 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.545 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 92.2 m-70 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.441 -0.882 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.466 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.466 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.6 m-70 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.55 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 84.4 m . . . . . 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 96.5 m-70 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 92.2 m-70 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m . . . . . 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.429 ' HA ' ' CD2' ' A' ' 12' ' ' HIS . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.718 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.429 ' CD2' ' HA ' ' A' ' 8' ' ' CYS . 91.2 m-70 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.718 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.566 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t . . . . . 0 CA--C 1.509 -0.597 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.545 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.441 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.545 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.455 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.0 m-70 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 CA--C 1.502 -0.888 0 CA-C-O 121.214 0.53 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.423 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 93.8 m-70 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m . . . . . 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.446 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t . . . . . 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.425 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 94.8 m-70 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.434 -1.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.449 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t . . . . . 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.0 m . . . . . 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t . . . . . 0 C--O 1.217 -0.632 0 CA-C-O 121.844 0.83 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.422 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.413 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.443 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.443 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 95.1 m-70 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.217 -0.606 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' HD21 ' A' ' 15' ' ' LEU . 96.8 m-70 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.216 -0.682 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.518 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.486 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.1 m-70 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.553 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m . . . . . 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.4 t -62.46 -52.52 63.21 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 121.266 0.555 . . . . 0.0 110.479 -177.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.4 t -74.53 -4.14 35.12 Favored 'General case' 0 C--N 1.295 -1.761 0 CA-C-O 121.28 0.562 . . . . 0.0 111.863 -176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -98.41 -14.63 20.02 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.435 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 33.6 t70 -100.1 117.43 63.28 Favored Pre-proline 0 C--O 1.214 -0.814 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.81 -50.87 10.04 Favored 'Trans proline' 0 CA--C 1.555 1.564 0 C-N-CA 123.333 2.689 . . . . 0.0 116.32 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 32.4 Cg_exo -64.5 -24.61 63.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 121.582 1.601 . . . . 0.0 112.291 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 1.5 t -95.68 7.95 44.83 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -123.14 -51.03 1.89 Allowed 'General case' 0 C--O 1.217 -0.642 0 O-C-N 121.635 -0.666 . . . . 0.0 110.19 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -64.81 -23.13 67.15 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.652 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -89.32 0.48 56.77 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.181 0.515 . . . . 0.0 110.047 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.52 ' HB3' HD21 ' A' ' 15' ' ' LEU . 90.7 m-70 -133.69 60.83 49.16 Favored Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.716 -174.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 92.3 Cg_endo -77.93 1.1 9.23 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 122.797 2.331 . . . . 0.0 114.095 -171.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -82.02 -50.31 9.26 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.356 0.598 . . . . 0.0 109.873 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -89.87 -30.11 18.13 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.609 178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 60.5 m -122.01 89.92 3.21 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.19 0 O-C-N 122.213 -0.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.043 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.6 t -121.71 -39.71 2.61 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 122.047 0.927 . . . . 0.0 109.456 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.03 -24.19 67.62 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.448 -177.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 t -112.42 18.27 18.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -116.02 100.42 53.5 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -42.38 -47.86 7.07 Favored 'Trans proline' 0 CA--C 1.563 1.955 0 C-N-CA 124.043 3.162 . . . . 0.0 116.474 -175.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.15 -41.06 67.38 Favored 'Trans proline' 0 C--N 1.39 2.725 0 C-N-CA 122.261 1.974 . . . . 0.0 113.326 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 22.4 p -102.1 -15.3 16.77 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.897 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -62.34 -40.15 95.44 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -63.15 -15.01 55.45 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.366 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 96.9 mttt -90.82 -13.62 33.45 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 123.693 0.797 . . . . 0.0 109.029 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -133.02 47.99 3.13 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.542 -175.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.32 -10.15 23.79 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.731 1.621 . . . . 0.0 111.55 -175.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.11 -61.55 2.19 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.601 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.52 -31.05 17.82 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.701 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.43 ' SG ' ' HG ' ' A' ' 15' ' ' LEU . 63.4 m -103.84 89.33 3.28 Favored 'General case' 0 N--CA 1.405 -2.704 0 CA-C-O 121.228 0.537 . . . . 0.0 109.713 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 116.24 -0.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.469 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.2 t -65.95 -42.43 89.99 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.963 0.887 . . . . 0.0 109.07 -178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.3 t -70.93 -9.7 58.3 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.066 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.9 m -89.43 -7.8 54.36 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -119.77 112.64 35.09 Favored Pre-proline 0 C--N 1.312 -1.064 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.341 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.94 -51.81 9.28 Favored 'Trans proline' 0 CA--C 1.56 1.798 0 C-N-CA 122.863 2.375 . . . . 0.0 116.009 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -61.19 -31.25 89.8 Favored 'Trans proline' 0 C--N 1.378 2.104 0 CA-C-N 121.593 1.605 . . . . 0.0 112.572 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.8 t -77.42 -45.55 25.47 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -62.44 -34.98 77.86 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.751 1.221 . . . . 0.0 110.364 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -58.72 -21.79 55.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.493 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.402 ' C ' ' HD3' ' A' ' 13' ' ' PRO . 64.0 mttp -89.54 -8.27 53.09 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 121.207 0.527 . . . . 0.0 109.836 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.498 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.1 m-70 -131.84 48.53 3.7 Favored Pre-proline 0 CA--C 1.558 1.255 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.959 -173.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 2.9 Cg_exo -74.11 -13.18 23.6 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.219 1.946 . . . . 0.0 111.056 -176.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -66.68 -43.21 85.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.03 176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 pp -89.67 -37.71 14.4 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.023 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 55.7 m -115.6 91.21 3.53 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-O 120.828 0.346 . . . . 0.0 110.355 176.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.586 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 t -71.18 -29.02 64.66 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 122.378 1.085 . . . . 0.0 109.11 -177.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 44.5 t -63.51 -20.86 65.96 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.864 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.5 t -97.28 3.35 51.3 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.714 -0.616 . . . . 0.0 110.274 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -120.18 95.07 49.04 Favored Pre-proline 0 C--N 1.314 -0.945 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -47.05 -47.5 16.62 Favored 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.0 2.467 . . . . 0.0 115.159 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -54.39 -39.85 85.6 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 121.788 1.659 . . . . 0.0 113.395 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 13.6 p -86.9 -32.75 20.02 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.236 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 49.7 ttp180 -54.82 -43.39 72.91 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 124.284 1.034 . . . . 0.0 111.806 -177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -61.52 -19.97 62.7 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.537 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -90.68 -6.38 54.58 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.171 0.51 . . . . 0.0 109.796 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.429 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 98.8 m-70 -133.13 64.18 69.27 Favored Pre-proline 0 C--O 1.247 0.926 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -73.49 -16.12 24.48 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.818 2.346 . . . . 0.0 110.706 -179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -55.73 -53.39 57.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.117 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -97.0 -35.92 10.69 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.838 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 9' ' ' ARG . 53.7 t -138.54 -81.75 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.875 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.951 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.725 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t -76.95 -32.14 57.1 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.0 t -63.18 -19.31 64.38 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.79 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -94.46 -3.24 50.4 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.847 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.472 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 36.3 t70 -105.51 119.87 51.31 Favored Pre-proline 0 C--O 1.214 -0.792 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.388 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 58.4 Cg_exo -42.88 -52.95 4.27 Favored 'Trans proline' 0 CA--C 1.566 2.083 0 C-N-CA 124.083 3.189 . . . . 0.0 116.739 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.472 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 35.6 Cg_exo -63.61 -22.61 70.37 Favored 'Trans proline' 0 C--N 1.375 1.95 0 CA-C-N 121.463 1.558 . . . . 0.0 112.162 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.9 t -103.96 11.15 35.79 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.989 0.899 . . . . 0.0 109.346 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 52.1 ttp180 -116.29 -38.82 3.49 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.863 0.84 . . . . 0.0 108.96 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.47 -27.49 64.46 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.153 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -92.56 0.91 57.49 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.052 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.449 ' N ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-70 -142.73 52.63 2.37 Favored Pre-proline 0 C--N 1.314 -0.961 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.462 -174.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 4.4 Cg_exo -74.62 -16.37 21.28 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 122.04 1.827 . . . . 0.0 112.646 -173.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.46 -42.06 79.33 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.057 0.456 . . . . 0.0 110.723 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -93.95 -50.56 5.27 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 58.2 m -89.19 94.71 10.02 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.961 -175.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.82 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.0 t -82.66 -34.06 27.55 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 t -70.7 -11.33 60.88 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.825 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 t -88.78 -6.81 57.14 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -104.38 110.97 65.05 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -48.7 -49.23 15.31 Favored 'Trans proline' 0 CA--C 1.562 1.893 0 C-N-CA 122.906 2.404 . . . . 0.0 115.322 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.75 -35.9 98.6 Favored 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.089 1.859 . . . . 0.0 112.568 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.545 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 39.1 t -74.21 -53.64 9.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.254 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -53.79 -41.19 66.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.732 0.813 . . . . 0.0 111.635 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.71 -22.3 57.11 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.73 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.8 mttp -96.19 -6.95 37.01 Favored 'General case' 0 N--CA 1.421 -1.883 0 O-C-N 122.043 -0.41 . . . . 0.0 110.407 178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.545 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 92.2 m-70 -132.2 48.53 3.65 Favored Pre-proline 0 C--N 1.31 -1.12 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -173.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -79.16 -5.6 14.49 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 121.511 1.474 . . . . 0.0 111.079 -176.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -86.72 -42.85 13.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.182 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.14 -23.17 22.52 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.812 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -150.32 -74.85 0.16 Allowed 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 120.856 0.36 . . . . 0.0 110.297 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.006 0 O-C-N 122.005 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.6 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.64 -35.36 9.52 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.536 0.684 . . . . 0.0 109.589 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 t -68.22 -18.88 64.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.375 0.607 . . . . 0.0 111.115 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -89.07 -3.85 58.55 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-O 121.404 0.621 . . . . 0.0 110.236 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -102.83 112.2 65.53 Favored Pre-proline 0 C--N 1.306 -1.298 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.21 -51.21 11.08 Favored 'Trans proline' 0 CA--C 1.566 2.103 0 C-N-CA 122.745 2.297 . . . . 0.0 115.523 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -56.78 -38.21 96.25 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 121.705 1.603 . . . . 0.0 112.146 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.466 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 42.3 t -71.4 -53.89 12.54 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 175.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HG3' ' HB3' ' A' ' 16' ' ' CYS . 54.0 ttp180 -51.27 -43.94 61.68 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 126.039 1.736 . . . . 0.0 112.229 -175.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.67 -9.56 28.57 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' NZ ' ' HA ' ' A' ' 8' ' ' CYS . 36.4 mtmm -99.83 -0.25 40.13 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.317 0.579 . . . . 0.0 109.789 174.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.466 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.6 m-70 -136.18 51.2 4.88 Favored Pre-proline 0 CA--C 1.547 0.85 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.659 -174.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 12' ' ' HIS . 6.2 Cg_exo -77.3 11.11 2.2 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.648 2.232 . . . . 0.0 111.342 -176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.04 -47.39 18.5 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.216 177.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.55 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -112.48 -19.34 12.17 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.917 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB3' ' HG3' ' A' ' 9' ' ' ARG . 84.4 m -101.13 100.37 10.93 Favored 'General case' 0 N--CA 1.409 -2.506 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.349 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.413 0 O-C-N 122.2 -0.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -1.245 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 34.0 t -62.89 -50.17 71.95 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.512 0.673 . . . . 0.0 111.223 -175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 34.6 t -70.6 -15.49 62.76 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.397 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -99.81 7.47 44.97 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.317 0.58 . . . . 0.0 109.503 176.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -129.76 102.11 18.11 Favored Pre-proline 0 N--CA 1.438 -1.026 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.54 -50.37 6.97 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.671 2.914 . . . . 0.0 115.363 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -63.47 -13.69 37.84 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.061 1.841 . . . . 0.0 113.254 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -96.93 -48.02 5.6 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 43.4 ttp180 -60.29 -39.18 86.0 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.095 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -68.05 -9.28 44.69 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -95.31 -8.65 35.27 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 96.5 m-70 -136.45 51.82 5.44 Favored Pre-proline 0 CA--C 1.556 1.203 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.588 -173.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.59 -24.26 18.9 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.649 1.566 . . . . 0.0 112.628 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.47 -13.3 46.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.673 0.749 . . . . 0.0 109.864 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 40.8 tp -88.49 -48.48 7.57 Favored 'General case' 0 N--CA 1.414 -2.265 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.1 t -146.38 -63.22 0.31 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 O-C-N 122.147 -0.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.774 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 t -85.27 -31.15 23.25 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.6 -11.19 60.78 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.499 0.666 . . . . 0.0 110.761 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.5 m -88.25 -5.59 58.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.18 110.66 58.38 Favored Pre-proline 0 N--CA 1.44 -0.951 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.809 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.7 -48.39 19.37 Favored 'Trans proline' 0 CA--C 1.557 1.641 0 C-N-CA 123.094 2.529 . . . . 0.0 115.734 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -55.73 -43.43 57.53 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 121.692 1.595 . . . . 0.0 111.967 176.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -67.99 -46.99 69.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 123.041 0.213 . . . . 0.0 110.628 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -53.0 -38.86 62.66 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.729 1.212 . . . . 0.0 109.522 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -52.99 -27.26 18.31 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -92.03 -6.09 51.72 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-O 120.895 0.378 . . . . 0.0 110.416 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 92.2 m-70 -129.26 70.48 81.74 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.183 -174.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -83.83 -17.04 6.18 Favored 'Trans proline' 0 N--CA 1.443 -1.498 0 C-N-CA 122.431 2.087 . . . . 0.0 112.984 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.13 -50.01 21.27 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.136 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -89.11 -16.48 31.37 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 119.204 -0.998 . . . . 0.0 111.204 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 12' ' ' HIS . 71.6 m -127.63 93.25 3.66 Favored 'General case' 0 N--CA 1.399 -3.025 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.993 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 116.651 -0.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.342 0 N-CA-C 110.589 -1.005 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -80.2 -29.8 38.63 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 38.8 t -73.07 -7.24 50.39 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 121.952 0.882 . . . . 0.0 109.22 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -97.72 -9.76 26.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.723 175.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.429 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 35.7 t70 -113.78 118.94 42.18 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.494 -174.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 1.4 Cg_endo -40.23 -53.33 2.6 Favored 'Trans proline' 0 CA--C 1.557 1.66 0 C-N-CA 124.521 3.481 . . . . 0.0 117.316 -175.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.52 -43.15 34.02 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 122.697 2.265 . . . . 0.0 113.242 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.429 ' HA ' ' CD2' ' A' ' 12' ' ' HIS . 9.2 p -104.04 21.06 17.1 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.564 0.697 . . . . 0.0 112.668 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.718 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 73.3 ttt180 -121.97 -55.54 1.88 Allowed 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.101 0.953 . . . . 0.0 110.209 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -63.64 -26.32 68.62 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.874 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -96.43 2.92 53.02 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.828 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.429 ' CD2' ' HA ' ' A' ' 8' ' ' CYS . 91.2 m-70 -138.06 76.55 38.99 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-O 120.875 0.369 . . . . 0.0 110.163 -174.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -79.11 -23.11 7.98 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.702 1.602 . . . . 0.0 113.175 -175.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -80.09 -44.41 20.05 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.424 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 pp -89.22 -16.28 31.66 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.06 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.718 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 47.6 t -134.85 -76.34 0.46 Allowed 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.048 0 O-C-N 122.224 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.354 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.566 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 8.1 t -78.51 -50.03 12.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.85 -14.39 62.72 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.035 -177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 m -89.04 -3.31 58.73 Favored 'General case' 0 N--CA 1.418 -2.071 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.109 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.545 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 28.2 t70 -114.73 120.58 37.26 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.441 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 86.3 Cg_exo -37.06 -53.08 1.29 Allowed 'Trans proline' 0 CA--C 1.561 1.834 0 C-N-CA 125.042 3.828 . . . . 0.0 118.019 -173.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.545 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 53.2 Cg_exo -58.39 -29.52 88.51 Favored 'Trans proline' 0 C--N 1.379 2.177 0 CA-C-N 121.651 1.625 . . . . 0.0 113.042 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 42.4 t -92.6 -35.88 13.31 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -58.24 -36.76 73.67 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.454 1.101 . . . . 0.0 110.175 178.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -55.98 -29.93 60.99 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.666 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -89.82 -3.24 58.22 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.455 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 96.0 m-70 -135.77 67.29 64.46 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -173.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.501 ' HA ' ' N ' ' A' ' 17' ' ' NH2 . 74.4 Cg_endo -78.8 -7.86 15.62 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.177 1.918 . . . . 0.0 111.614 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.98 -43.73 97.99 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.896 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.9 pt? -111.86 -39.77 4.45 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.051 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 m -102.88 -77.52 0.56 Allowed 'General case' 0 N--CA 1.414 -2.248 0 O-C-N 122.007 -0.433 . . . . 0.0 109.839 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . 0.501 ' N ' ' HA ' ' A' ' 13' ' ' PRO . . . . . . . . 0 C--N 1.319 -0.733 0 O-C-N 122.095 -0.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.439 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.6 t -67.46 -50.8 57.53 Favored 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.199 0.6 . . . . 0.0 111.456 -176.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.7 t -69.09 -15.5 63.45 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -89.76 -8.7 51.61 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.824 0.821 . . . . 0.0 109.391 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.41 110.63 55.59 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -50.66 -47.22 25.95 Favored 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 122.86 2.373 . . . . 0.0 115.507 -177.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.11 -42.15 66.72 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 121.773 1.649 . . . . 0.0 112.401 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 8.9 t -70.12 -47.93 59.69 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 38.4 ttm180 -56.41 -38.57 71.72 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.338 1.055 . . . . 0.0 111.0 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -54.71 -28.66 49.58 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 114.32 -1.309 . . . . 0.0 112.015 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -93.4 0.71 56.94 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.673 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.423 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 93.8 m-70 -142.58 67.63 19.58 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -174.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.37 -7.4 16.95 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.303 2.002 . . . . 0.0 110.368 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -57.66 -50.3 73.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.201 -1.363 . . . . 0.0 112.114 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.5 pt? -102.48 -20.08 14.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.393 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 26.3 m -106.22 84.06 1.98 Allowed 'General case' 0 N--CA 1.409 -2.512 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.066 0 O-C-N 122.25 -0.281 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.937 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.2 t -61.76 -40.41 95.05 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 121.927 0.87 . . . . 0.0 110.558 -178.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.1 t -67.53 -15.15 63.51 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.856 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.9 t -96.42 -7.33 35.24 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -102.32 106.81 50.61 Favored Pre-proline 0 C--N 1.313 -0.986 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.03 -49.75 12.1 Favored 'Trans proline' 0 CA--C 1.557 1.656 0 C-N-CA 122.967 2.445 . . . . 0.0 115.548 -177.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -52.79 -48.07 24.0 Favored 'Trans proline' 0 C--N 1.393 2.91 0 C-N-CA 121.872 1.715 . . . . 0.0 113.118 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 15.8 p -87.84 -20.67 25.73 Favored 'General case' 0 N--CA 1.438 -1.028 0 C-N-CA 118.147 -1.421 . . . . 0.0 112.021 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 5.7 tmm_? -66.59 -38.36 86.85 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -62.38 -19.14 63.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.091 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 44.7 mmtm -89.4 -12.63 39.75 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.4 0.68 . . . . 0.0 110.15 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 97.0 m-70 -133.93 49.92 4.63 Favored Pre-proline 0 C--N 1.31 -1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.52 -22.51 12.19 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.314 1.343 . . . . 0.0 112.906 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.42 -17.15 26.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 42.6 tp -88.22 -45.73 9.84 Favored 'General case' 0 N--CA 1.416 -2.145 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -136.72 -63.16 0.63 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.451 -1.249 . . . . 0.0 110.944 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.585 0 O-C-N 120.599 -1.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.384 0 N-CA-C 111.653 -0.579 . . . . 0.0 111.653 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -72.73 -28.95 62.96 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 39.0 t -77.24 -1.3 28.89 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 122.223 1.011 . . . . 0.0 110.154 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 t -105.68 2.61 28.22 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -121.64 103.72 40.46 Favored Pre-proline 0 N--CA 1.435 -1.207 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.955 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -45.33 -47.17 13.17 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 123.456 2.771 . . . . 0.0 115.81 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -49.22 -48.64 17.81 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.294 1.996 . . . . 0.0 113.665 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.9 p -96.37 12.04 32.66 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.607 -177.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 67.4 ttt180 -113.3 -48.5 2.95 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.261 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -59.85 -26.96 66.24 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.981 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -89.56 -4.64 57.78 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.137 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -135.35 56.72 16.85 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -79.77 9.05 3.67 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.75 1.633 . . . . 0.0 110.249 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.35 -38.43 55.88 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.764 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.446 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.6 pt? -105.11 -38.75 6.46 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 t -149.5 91.5 1.83 Allowed 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.17 0 CA-C-N 116.276 -0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.995 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.7 t -71.39 -38.5 71.48 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.839 0.828 . . . . 0.0 108.797 -178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.425 ' HA ' ' CG ' ' A' ' 9' ' ' ARG . 36.1 t -66.11 -22.19 66.38 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.755 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -89.69 0.04 57.23 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.243 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -120.06 98.93 49.02 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -46.98 -46.66 18.27 Favored 'Trans proline' 0 CA--C 1.556 1.603 0 C-N-CA 123.088 2.525 . . . . 0.0 115.017 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -46.78 -48.99 13.0 Favored 'Trans proline' 0 C--N 1.389 2.664 0 C-N-CA 122.41 2.073 . . . . 0.0 113.431 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 18.6 p -86.67 -34.58 19.71 Favored 'General case' 0 C--O 1.204 -1.334 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.531 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' A' ' 3' ' ' CYS . 2.1 tmm_? -63.08 -34.48 77.68 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.676 0.751 . . . . 0.0 110.71 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -60.94 -23.54 65.37 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.051 175.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -96.03 -9.56 30.66 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.429 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.51 ' HB3' ' HB3' ' A' ' 15' ' ' LEU . 94.8 m-70 -132.95 81.81 56.79 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -170.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -82.82 -16.95 7.34 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.404 2.069 . . . . 0.0 111.821 177.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -92.98 -19.74 21.29 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.31 0.576 . . . . 0.0 110.897 -177.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 12' ' ' HIS . 64.3 tp -87.73 -26.14 23.08 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.5 t -142.88 92.37 2.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 174.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.411 0 CA-C-N 116.057 -0.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.037 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 t -110.85 -57.88 2.17 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.353 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.2 t -61.47 -28.71 69.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.718 -174.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.5 m -89.98 -11.3 42.03 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.377 -0.827 . . . . 0.0 111.315 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -99.75 112.61 64.06 Favored Pre-proline 0 C--N 1.309 -1.179 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_exo -43.55 -49.51 7.7 Favored 'Trans proline' 0 CA--C 1.56 1.792 0 C-N-CA 123.811 3.007 . . . . 0.0 116.42 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -64.4 -21.71 66.36 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.508 1.472 . . . . 0.0 112.304 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.3 t -105.19 11.8 32.67 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.212 1.006 . . . . 0.0 108.323 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.449 ' HG3' ' SG ' ' A' ' 16' ' ' CYS . 54.7 ttp180 -119.89 -56.99 1.99 Allowed 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.655 -0.653 . . . . 0.0 110.773 -178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -70.54 -17.44 62.94 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.175 -174.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 9.4 mmpt? -93.94 0.2 55.96 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 175.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -140.73 55.42 5.73 Favored Pre-proline 0 C--N 1.315 -0.894 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -72.48 -21.08 22.99 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.406 2.07 . . . . 0.0 113.295 -170.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -86.04 -33.2 21.08 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.49 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 pp -89.56 -20.95 23.15 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.417 0.627 . . . . 0.0 110.818 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' HG3' ' A' ' 9' ' ' ARG . 36.1 t -140.82 -79.18 0.28 Allowed 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.722 175.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.625 0 O-C-N 122.219 -0.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.489 0 N-CA-C 110.196 -1.162 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.7 t -80.95 -34.23 33.35 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-O 121.496 0.665 . . . . 0.0 109.347 -173.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 33.2 t -75.75 -3.13 33.16 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 122.089 0.947 . . . . 0.0 110.076 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.71 -8.61 51.95 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 173.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -101.02 118.09 61.09 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -49.4 -49.91 14.37 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.25 2.633 . . . . 0.0 115.884 -177.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.11 -42.72 60.57 Favored 'Trans proline' 0 C--N 1.369 1.641 0 CA-C-N 122.024 1.759 . . . . 0.0 111.651 175.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.2 t -80.34 7.64 9.19 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.756 0.788 . . . . 0.0 111.129 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 3' ' ' CYS . 32.3 ttt180 -118.97 -47.9 2.48 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 121.576 -0.703 . . . . 0.0 109.669 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -65.64 -22.42 66.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.425 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -89.08 -1.8 58.26 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.858 0.837 . . . . 0.0 109.407 177.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -132.16 52.36 8.94 Favored Pre-proline 0 N--CA 1.434 -1.272 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.29 -175.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.54 -10.21 28.35 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 121.414 1.409 . . . . 0.0 111.028 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.7 -55.15 7.23 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.919 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 pp -94.56 -24.92 17.03 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.638 -0.425 . . . . 0.0 112.122 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.0 m -100.91 -87.89 0.38 Allowed 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.917 0 O-C-N 121.682 -0.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.722 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.8 t -64.47 -39.17 93.31 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.039 0.936 . . . . 0.0 111.226 -175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.422 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 37.0 t -63.49 -19.32 64.65 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -104.17 5.33 34.87 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.537 -0.727 . . . . 0.0 109.404 177.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -126.27 99.14 31.35 Favored Pre-proline 0 C--N 1.312 -1.023 0 CA-C-O 120.927 0.394 . . . . 0.0 109.992 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.413 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 76.2 Cg_exo -44.51 -48.92 9.67 Favored 'Trans proline' 0 CA--C 1.56 1.799 0 C-N-CA 124.223 3.282 . . . . 0.0 116.883 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' PRO . 5.7 Cg_endo -47.91 -42.61 31.22 Favored 'Trans proline' 0 C--N 1.391 2.788 0 C-N-CA 122.84 2.36 . . . . 0.0 114.078 -177.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.443 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 30.6 p -94.18 -30.67 14.49 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.824 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 3' ' ' CYS . 53.9 ttp180 -53.88 -38.36 64.66 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.055 0.942 . . . . 0.0 111.987 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.15 -23.41 55.12 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.231 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -95.18 -6.36 41.88 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.385 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.443 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 95.1 m-70 -129.51 76.78 78.25 Favored Pre-proline 0 C--N 1.312 -1.059 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.88 -7.24 3.29 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 122.006 1.804 . . . . 0.0 111.323 177.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.51 -56.29 5.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.128 -176.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -89.52 -14.72 34.58 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.462 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t -123.92 91.35 3.44 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.128 0 CA-C-N 116.238 -0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.588 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.3 t -72.22 -39.23 68.68 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.4 t -69.11 -10.93 60.05 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.137 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.8 t -89.42 -18.72 26.23 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 177.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -95.35 119.56 65.26 Favored Pre-proline 0 C--O 1.213 -0.853 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.405 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -37.67 -53.98 1.35 Allowed 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 124.77 3.646 . . . . 0.0 117.734 -175.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -64.72 -24.17 62.38 Favored 'Trans proline' 0 C--N 1.372 1.766 0 CA-C-N 121.659 1.628 . . . . 0.0 112.415 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.2 t -104.43 15.96 27.1 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.08 0.943 . . . . 0.0 108.734 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -116.76 -47.07 2.72 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -57.55 -33.01 67.68 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.422 -1.263 . . . . 0.0 112.551 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -89.48 5.26 46.17 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.04 -177.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.41 ' HB3' HD21 ' A' ' 15' ' ' LEU . 96.8 m-70 -138.44 50.88 3.28 Favored Pre-proline 0 C--N 1.307 -1.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.521 -174.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.45 -16.75 55.49 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.336 2.024 . . . . 0.0 113.892 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.59 -43.56 54.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.038 0.447 . . . . 0.0 110.284 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.9 OUTLIER -91.32 -39.75 11.87 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.295 -179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.8 m -90.9 89.93 7.68 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.137 0 CA-C-N 116.28 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.825 0 N-CA-C 110.191 -1.163 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.4 t -84.42 -41.45 16.65 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -73.43 -5.34 39.28 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.945 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 p -89.72 -14.64 34.24 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 121.388 -0.82 . . . . 0.0 109.585 173.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD2' ' HD2' ' A' ' 7' ' ' PRO . 25.7 t70 -94.26 119.69 66.27 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.99 -59.06 0.85 Allowed 'Trans proline' 0 CA--C 1.56 1.785 0 C-N-CA 124.305 3.337 . . . . 0.0 117.288 -173.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.518 ' HD2' ' OD2' ' A' ' 5' ' ' ASP . 50.0 Cg_exo -58.45 -26.4 77.83 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 121.978 1.786 . . . . 0.0 113.06 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' O ' ' HD2' ' A' ' 12' ' ' HIS . 51.6 t -86.64 -41.01 14.57 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.8 ttp180 -58.31 -38.94 78.1 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.365 1.066 . . . . 0.0 110.6 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -54.52 -26.13 29.9 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 115.154 -0.93 . . . . 0.0 113.406 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -92.23 -4.83 53.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.128 0.49 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.486 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 94.1 m-70 -134.27 52.52 8.02 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.066 -0.515 . . . . 0.0 112.086 -175.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' CYS . 73.2 Cg_endo -76.72 3.43 6.48 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 121.831 1.688 . . . . 0.0 110.68 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -67.07 -62.49 1.4 Allowed 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 113.792 -1.549 . . . . 0.0 109.772 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.553 HD23 ' H ' ' A' ' 15' ' ' LEU . 2.3 pt? -89.72 -34.49 16.2 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.362 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 13' ' ' PRO . 70.8 m -96.09 88.44 4.85 Favored 'General case' 0 N--CA 1.412 -2.333 0 CA-C-O 120.964 0.412 . . . . 0.0 109.987 178.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.141 0 CA-C-N 116.355 -0.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_