data_2mtu_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 2mtu _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.758 0.313 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 . . . . . 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.496 0.189 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.555 0.217 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.873 0.368 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.706 0.289 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.409 0.147 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.55 0.214 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.802 0.334 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.754 0.311 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.754 0.311 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.418 0.151 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.388 0.137 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 120.548 0.213 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.3 0.095 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.582 0.23 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.783 0.325 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.826 0.346 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.2 p -106.66 49.19 0.81 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.611 0.72 . . . . 0.0 110.633 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p -75.75 -13.77 60.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.657 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -113.04 132.19 55.49 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.591 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.2 p -107.78 50.71 0.76 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.133 0.492 . . . . 0.0 110.55 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p -62.34 -31.39 72.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.554 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -113.37 139.93 48.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.552 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.4 p -109.34 51.65 0.74 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.221 0.534 . . . . 0.0 110.6 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p -62.42 -32.21 73.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -112.04 140.42 46.74 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.46 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.9 p -110.62 50.39 0.81 Allowed 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.468 0.651 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p -64.86 -22.21 66.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.537 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.5 ptt85 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.604 -179.926 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.454 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -109.3 75.58 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.577 0.703 . . . . 0.0 111.331 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p -70.71 -21.71 62.53 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.977 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -88.62 141.78 28.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.513 -179.801 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.69 76.23 0.97 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.498 0.666 . . . . 0.0 110.575 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p -62.94 -32.82 74.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.165 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.468 ' CZ ' ' C ' ' A' ' 13' ' ' ARG . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.686 HH12 ' HE ' ' A' ' 13' ' ' ARG . 44.1 mtm105 -72.8 54.08 0.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.686 ' HE ' HH12 ' A' ' 11' ' ' ARG . 35.9 ptt180 . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.484 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 8.9 p -108.74 62.29 0.6 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.433 0.635 . . . . 0.0 110.783 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p -61.66 -32.29 72.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.473 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -114.16 142.54 46.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.677 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.81 70.0 0.7 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.526 0.679 . . . . 0.0 110.782 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p -64.77 -32.44 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.904 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -93.79 129.62 40.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.549 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 t -88.83 49.83 1.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 110.097 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p -63.24 -25.81 68.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -112.45 21.88 15.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.0 mmt-85 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.164 -179.697 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.5 p -110.21 71.06 0.74 Allowed 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.382 0.611 . . . . 0.0 110.727 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p -68.86 -22.44 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.727 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.14 130.56 54.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 . . . . . 0 C--N 1.306 -1.315 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.668 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.8 p -105.6 49.28 0.81 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.819 0.819 . . . . 0.0 110.75 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p -74.63 -14.93 60.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.553 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 -110.87 142.41 42.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.485 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.5 p -108.9 61.16 0.6 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.498 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p -70.43 -21.17 62.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.838 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' CYS . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -130.71 157.75 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.427 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.419 ' C ' ' H ' ' A' ' 3' ' ' ABA . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -73.76 48.76 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 122.003 0.906 . . . . 0.0 110.687 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.419 ' H ' ' C ' ' A' ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p -62.84 -29.41 70.72 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.026 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.549 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 -77.66 147.88 35.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.642 -179.888 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.518 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -110.02 48.66 0.88 Allowed 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.796 0.807 . . . . 0.0 110.472 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m -101.54 2.1 38.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.752 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.422 ' O ' ' O ' ' A' ' 2' ' ' CYS . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -129.74 135.13 48.1 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.619 179.884 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.605 ' N ' ' CD2' ' A' ' 10' ' ' TYR . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.59 72.15 0.78 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.434 0.635 . . . . 0.0 111.01 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p -66.03 -32.86 74.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.605 ' CD2' ' N ' ' A' ' 1' ' ' GLY . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -93.71 130.23 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.549 -179.917 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 3.3 p -106.48 48.55 0.83 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.735 0.779 . . . . 0.0 111.202 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p -64.26 -25.26 67.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -112.68 140.59 47.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.515 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.13 48.92 0.82 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -79.72 -11.65 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.511 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -110.1 145.05 37.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 . . . . . 0 C--N 1.31 -1.128 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.173 179.848 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 p -105.47 48.83 0.82 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.484 0.659 . . . . 0.0 110.496 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p -63.23 -29.11 70.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.543 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -114.64 139.81 49.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ptt180 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.747 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.415 ' H2 ' ' H ' ' A' ' 2' ' ' CYS . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.448 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.3 p -107.26 49.16 0.81 Allowed 'General case' 0 CA--C 1.488 -1.421 0 CA-C-O 121.929 0.871 . . . . 0.0 110.616 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -69.03 -20.33 64.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 -128.46 130.31 47.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.558 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.7 p -110.58 50.16 0.82 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.833 0.825 . . . . 0.0 110.669 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.411 ' C ' ' HG1' ' A' ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p -73.33 -17.1 61.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -118.97 144.58 46.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ABA . . . . . 0.411 ' HG1' ' C ' ' A' ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.645 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.758 0.313 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 . . . . . 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.496 0.189 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.555 0.217 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.873 0.368 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.706 0.289 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.409 0.147 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.55 0.214 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.802 0.334 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.754 0.311 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.754 0.311 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.418 0.151 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.388 0.137 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 120.548 0.213 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.3 0.095 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.582 0.23 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.783 0.325 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.826 0.346 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.2 p -106.66 49.19 0.81 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.611 0.72 . . . . 0.0 110.633 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p -75.75 -13.77 60.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.657 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -113.04 132.19 55.49 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.591 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.2 p -107.78 50.71 0.76 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.133 0.492 . . . . 0.0 110.55 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p -62.34 -31.39 72.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.554 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -113.37 139.93 48.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.552 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.4 p -109.34 51.65 0.74 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.221 0.534 . . . . 0.0 110.6 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p -62.42 -32.21 73.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -112.04 140.42 46.74 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.46 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.9 p -110.62 50.39 0.81 Allowed 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.468 0.651 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p -64.86 -22.21 66.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.537 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.5 ptt85 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.604 -179.926 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.454 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -109.3 75.58 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.577 0.703 . . . . 0.0 111.331 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p -70.71 -21.71 62.53 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.977 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -88.62 141.78 28.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.513 -179.801 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.69 76.23 0.97 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.498 0.666 . . . . 0.0 110.575 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.462 ' HA ' ' HG3' ' A' ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p -62.94 -32.82 74.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.165 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.468 ' CZ ' ' C ' ' A' ' 13' ' ' ARG . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.721 HH12 ' HE ' ' A' ' 13' ' ' ARG . 44.1 mtm105 -72.8 54.08 0.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ABA . . . . . 0.462 ' HG3' ' HA ' ' A' ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.721 ' HE ' HH12 ' A' ' 11' ' ' ARG . 35.9 ptt180 . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.484 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 8.9 p -108.74 62.29 0.6 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.433 0.635 . . . . 0.0 110.783 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p -61.66 -32.29 72.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.473 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -114.16 142.54 46.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.687 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.81 70.0 0.7 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.526 0.679 . . . . 0.0 110.782 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p -64.77 -32.44 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.904 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -93.79 129.62 40.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.549 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 t -88.83 49.83 1.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 110.097 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p -63.24 -25.81 68.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.487 ' HE2' ' HG2' ' A' ' 12' ' ' ABA . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -112.45 21.88 15.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ABA . . . . . 0.487 ' HG2' ' HE2' ' A' ' 10' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.0 mmt-85 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.164 -179.697 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.5 p -110.21 71.06 0.74 Allowed 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.382 0.611 . . . . 0.0 110.727 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p -68.86 -22.44 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.727 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.14 130.56 54.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 . . . . . 0 C--N 1.306 -1.315 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.668 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.8 p -105.6 49.28 0.81 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.819 0.819 . . . . 0.0 110.75 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p -74.63 -14.93 60.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.553 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 -110.87 142.41 42.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.485 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.5 p -108.9 61.16 0.6 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.498 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p -70.43 -21.17 62.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.838 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' CYS . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -130.71 157.75 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.427 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.547 ' C ' ' HN2' ' A' ' 3' ' ' ABA . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -73.76 48.76 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 122.003 0.906 . . . . 0.0 110.687 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.547 ' HN2' ' C ' ' A' ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p -62.84 -29.41 70.72 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.026 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.549 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 -77.66 147.88 35.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.642 -179.888 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.518 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -110.02 48.66 0.88 Allowed 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.796 0.807 . . . . 0.0 110.472 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m -101.54 2.1 38.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.752 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.422 ' O ' ' O ' ' A' ' 2' ' ' CYS . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -129.74 135.13 48.1 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.619 179.884 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.452 ' N ' ' CD2' ' A' ' 10' ' ' TYR . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.59 72.15 0.78 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.434 0.635 . . . . 0.0 111.01 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p -66.03 -32.86 74.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.452 ' CD2' ' N ' ' A' ' 1' ' ' GLY . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -93.71 130.23 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ABA . . . . . 0.502 ' HG3' ' N ' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.502 ' N ' ' HG3' ' A' ' 12' ' ' ABA . 50.9 ptt85 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.549 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 3.3 p -106.48 48.55 0.83 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.735 0.779 . . . . 0.0 111.202 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p -64.26 -25.26 67.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -112.68 140.59 47.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.515 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.13 48.92 0.82 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -79.72 -11.65 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.511 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -110.1 145.05 37.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 . . . . . 0 C--N 1.31 -1.128 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.173 179.848 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 p -105.47 48.83 0.82 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.484 0.659 . . . . 0.0 110.496 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p -63.23 -29.11 70.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.543 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -114.64 139.81 49.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ptt180 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.747 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.448 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.3 p -107.26 49.16 0.81 Allowed 'General case' 0 CA--C 1.488 -1.421 0 CA-C-O 121.929 0.871 . . . . 0.0 110.616 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -69.03 -20.33 64.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 -128.46 130.31 47.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.558 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.7 p -110.58 50.16 0.82 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.833 0.825 . . . . 0.0 110.669 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p -73.33 -17.1 61.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -118.97 144.58 46.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.645 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.758 0.313 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 . . . . . 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.496 0.189 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.555 0.217 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.873 0.368 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.706 0.289 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.409 0.147 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.55 0.214 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.802 0.334 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.754 0.311 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.754 0.311 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.418 0.151 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.388 0.137 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p . . . . . 0 N--CA 1.457 -0.115 0 CA-C-O 120.548 0.213 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.3 0.095 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.582 0.23 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.783 0.325 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.826 0.346 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.2 p -106.66 49.19 0.81 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.611 0.72 . . . . 0.0 110.633 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.7 p -75.75 -13.77 60.31 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.657 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -84.58 118.6 71.46 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.35 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.03 -17.78 21.91 Favored 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 122.535 2.156 . . . . 0.0 112.36 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -80.64 -12.19 59.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.594 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.0 t -78.78 153.79 30.47 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.391 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -59.02 -44.06 91.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.282 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -97.97 120.85 39.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.3 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -113.04 132.19 55.49 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.591 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.2 p -107.78 50.71 0.76 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.133 0.492 . . . . 0.0 110.55 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.2 p -62.34 -31.39 72.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.554 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -107.36 118.16 54.25 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.132 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.08 -15.22 29.06 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.211 1.941 . . . . 0.0 112.606 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -79.96 -13.03 59.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -65.8 133.78 51.72 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.823 0.344 . . . . 0.0 110.215 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.2 mtp85 -61.26 -40.05 92.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.535 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -79.73 130.85 35.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.391 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -113.37 139.93 48.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.552 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.4 p -109.34 51.65 0.74 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.221 0.534 . . . . 0.0 110.6 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 92.6 p -62.42 -32.21 73.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.606 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -108.46 118.17 52.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.244 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.92 -14.57 29.49 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.606 2.204 . . . . 0.0 112.474 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -80.31 -13.02 59.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.533 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -66.07 133.75 51.42 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.306 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.63 -40.08 93.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -80.14 131.07 35.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.442 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -112.04 140.42 46.74 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.466 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.46 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.9 p -110.62 50.39 0.81 Allowed 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.468 0.651 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 98.2 p -64.86 -22.21 66.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.537 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -96.06 118.57 65.61 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.248 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.19 -15.82 28.55 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.44 2.093 . . . . 0.0 112.517 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -79.62 -13.3 59.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.687 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.2 t -81.38 163.31 22.93 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.448 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -60.79 -39.1 87.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.532 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -105.53 134.23 48.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.145 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.511 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.5 ptt85 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.604 -179.926 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.454 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -109.3 75.58 0.96 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.577 0.703 . . . . 0.0 111.331 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 96.6 p -70.71 -21.71 62.53 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.977 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -124.38 138.61 31.28 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.305 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.96 -25.94 27.17 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 123.19 2.593 . . . . 0.0 112.44 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.517 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 44.3 mmm-85 -78.81 -7.92 58.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.64 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 5' ' ' ASP . 40.5 t -61.5 131.35 49.85 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.998 0.428 . . . . 0.0 110.292 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -59.89 -23.0 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.549 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -95.6 115.27 27.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.399 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -88.62 141.78 28.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.776 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.513 -179.801 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.69 76.23 0.97 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.498 0.666 . . . . 0.0 110.575 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.462 ' HA ' ' HG3' ' A' ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.2 p -62.94 -32.82 74.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.165 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -103.34 136.86 19.15 Favored Pre-proline 0 CA--C 1.534 0.346 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.053 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.11 -28.43 12.8 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.856 1.704 . . . . 0.0 112.249 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.09 -5.64 56.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.879 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.4 t -54.49 138.87 39.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.276 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -60.23 -39.31 86.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.16 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.468 ' CZ ' ' C ' ' A' ' 13' ' ' ARG . 47.7 t80 -93.74 106.27 18.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.721 HH12 ' HE ' ' A' ' 13' ' ' ARG . 44.1 mtm105 -72.8 54.08 0.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.75 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . 0.462 ' HG3' ' HA ' ' A' ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.721 ' HE ' HH12 ' A' ' 11' ' ' ARG . 35.9 ptt180 . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.484 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 8.9 p -108.74 62.29 0.6 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.433 0.635 . . . . 0.0 110.783 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.1 p -61.66 -32.29 72.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -109.3 118.66 50.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.079 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.38 -15.17 28.15 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.062 1.841 . . . . 0.0 112.345 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -79.66 -12.71 59.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.705 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -68.03 133.13 48.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.217 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -60.03 -45.06 94.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.788 0.328 . . . . 0.0 110.354 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.473 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 92.1 t80 -78.86 129.7 34.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.664 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -114.16 142.54 46.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.504 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.687 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.81 70.0 0.7 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.526 0.679 . . . . 0.0 110.782 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.8 p -64.77 -32.44 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.904 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -107.42 118.29 53.85 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.331 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -53.31 -29.23 46.55 Favored 'Trans proline' 0 N--CA 1.501 1.92 0 C-N-CA 122.706 2.271 . . . . 0.0 112.393 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? -78.66 -9.79 59.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.895 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 41.2 t -59.32 133.94 56.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.472 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -59.16 -25.95 64.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.148 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -86.71 119.75 27.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.392 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -93.79 129.62 40.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.509 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.549 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 t -88.83 49.83 1.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 110.097 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 99.5 p -63.24 -25.81 68.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.757 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -104.04 122.55 43.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.104 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.23 -17.45 31.14 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.778 1.652 . . . . 0.0 112.316 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.6 mtm180 -83.3 -10.46 58.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.07 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.52 156.31 31.06 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.843 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -61.26 -25.27 66.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.487 ' HE2' ' HG2' ' A' ' 12' ' ' ABA . 59.9 t80 -102.66 114.11 28.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.226 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -112.45 21.88 15.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.088 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . 0.487 ' HG2' ' HE2' ' A' ' 10' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.0 mmt-85 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.164 -179.697 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 15.5 p -110.21 71.06 0.74 Allowed 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.382 0.611 . . . . 0.0 110.727 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.1 p -68.86 -22.44 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.727 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -89.52 118.62 69.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.25 -14.73 25.61 Favored 'Trans proline' 0 N--CA 1.491 1.332 0 C-N-CA 123.216 2.611 . . . . 0.0 112.011 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -79.65 -12.72 59.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.56 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.32 162.96 26.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.791 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -59.57 -43.82 93.49 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -100.79 116.84 33.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.14 130.56 54.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.521 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 . . . . . 0 C--N 1.306 -1.315 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.668 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 16.8 p -105.6 49.28 0.81 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.819 0.819 . . . . 0.0 110.75 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.2 p -74.63 -14.93 60.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.553 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -85.58 118.05 69.92 Favored Pre-proline 0 CA--C 1.547 0.842 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.996 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.11 -18.21 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 123.118 2.545 . . . . 0.0 112.047 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -80.28 -10.48 59.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.768 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.6 t -80.08 156.88 26.86 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.081 0.467 . . . . 0.0 109.847 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.54 -43.16 93.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.653 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -100.38 122.63 43.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.386 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.3 mtm-85 -110.87 142.41 42.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.637 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.485 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.5 p -108.9 61.16 0.6 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.498 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 83.1 p -70.43 -21.17 62.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.838 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -83.45 119.61 74.17 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.24 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.6 -23.89 7.97 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 123.003 2.469 . . . . 0.0 112.261 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -78.07 -25.58 47.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.3 t -64.17 152.86 39.54 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -56.13 -44.23 78.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.208 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' CYS . 88.8 t80 -98.93 126.19 44.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.223 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -130.71 157.75 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.675 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.2 mmm-85 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.427 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.547 ' C ' ' HN2' ' A' ' 3' ' ' ABA . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -73.76 48.76 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 122.003 0.906 . . . . 0.0 110.687 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.547 ' HN2' ' C ' ' A' ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.4 p -62.84 -29.41 70.72 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.026 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -112.17 119.7 43.4 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.674 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -54.05 -27.13 44.3 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.409 2.072 . . . . 0.0 112.368 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.44 0.61 32.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.549 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 43.5 t -53.91 131.59 40.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.072 0.463 . . . . 0.0 110.015 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -60.36 -46.42 90.01 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.925 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -108.3 121.02 44.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.943 0.402 . . . . 0.0 110.805 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.7 mtm180 -77.66 147.88 35.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.487 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.642 -179.888 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.518 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -110.02 48.66 0.88 Allowed 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.796 0.807 . . . . 0.0 110.472 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.6 m -101.54 2.1 38.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.752 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -101.98 117.88 60.51 Favored Pre-proline 0 CA--C 1.541 0.596 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.218 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.1 -18.92 26.92 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.101 1.867 . . . . 0.0 112.694 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 88.8 mmt-85 -86.06 -8.16 58.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.516 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -90.41 145.61 24.8 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -59.19 -44.42 92.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.422 ' O ' ' O ' ' A' ' 2' ' ' CYS . 41.5 t80 -86.66 114.68 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -129.74 135.13 48.1 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.471 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.619 179.884 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.452 ' N ' ' CD2' ' A' ' 10' ' ' TYR . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -110.59 72.15 0.78 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.434 0.635 . . . . 0.0 111.01 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 95.7 p -66.03 -32.86 74.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.009 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -108.71 119.48 49.06 Favored Pre-proline 0 CA--C 1.542 0.651 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.445 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -53.81 -28.81 49.7 Favored 'Trans proline' 0 N--CA 1.5 1.909 0 C-N-CA 122.445 2.096 . . . . 0.0 112.163 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -77.49 -10.75 59.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.905 -179.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 40.7 t -58.9 132.77 54.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.488 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -57.58 -24.44 56.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.452 ' CD2' ' N ' ' A' ' 1' ' ' GLY . 65.6 t80 -90.06 118.84 29.91 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.304 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -93.71 130.23 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.608 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . 0.502 ' HG3' ' N ' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.502 ' N ' ' HG3' ' A' ' 12' ' ' ABA . 50.9 ptt85 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.549 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 10' ' ' TYR . 3.3 p -106.48 48.55 0.83 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.735 0.779 . . . . 0.0 111.202 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 93.5 p -64.26 -25.26 67.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -117.68 118.86 34.69 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.385 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.36 -17.76 26.97 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.212 1.942 . . . . 0.0 112.218 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -80.84 -12.18 59.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.725 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.6 t -62.08 133.79 55.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.875 0.369 . . . . 0.0 110.667 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.8 ptt-85 -58.9 -21.44 57.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.834 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 86.3 t80 -111.2 126.38 54.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.428 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -112.68 140.59 47.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.515 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.2 p -106.13 48.92 0.82 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -79.72 -11.65 59.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.511 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -91.07 119.58 68.78 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.094 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -72.08 -13.34 28.66 Favored 'Trans proline' 0 N--CA 1.497 1.693 0 C-N-CA 122.743 2.296 . . . . 0.0 112.316 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.0 mtm105 -79.16 -12.87 59.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.553 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -83.66 157.0 22.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.6 mtp85 -61.98 -40.16 94.67 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.708 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -96.91 126.14 41.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.183 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -110.1 145.05 37.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.744 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 . . . . . 0 C--N 1.31 -1.128 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.173 179.848 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 p -105.47 48.83 0.82 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.484 0.659 . . . . 0.0 110.496 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 94.5 p -63.23 -29.11 70.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.543 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -120.37 129.5 25.3 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.37 -16.26 31.13 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.797 2.331 . . . . 0.0 112.24 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -80.54 -10.68 59.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.65 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 t -77.08 148.18 36.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.117 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -60.31 -21.8 62.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.316 . . . . 0.0 110.891 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -78.43 131.99 37.14 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.427 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -114.64 139.81 49.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.363 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ptt180 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.747 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.448 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 21.3 p -107.26 49.16 0.81 Allowed 'General case' 0 CA--C 1.488 -1.421 0 CA-C-O 121.929 0.871 . . . . 0.0 110.616 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -69.03 -20.33 64.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.594 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -88.92 119.13 69.83 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.661 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -72.33 -18.34 26.59 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.909 2.406 . . . . 0.0 112.107 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -78.88 -13.7 59.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.2 t -82.27 157.5 23.84 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.182 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -60.15 -44.85 94.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.587 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -94.32 122.38 36.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.601 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.6 ttp85 -128.46 130.31 47.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.584 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.558 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.7 p -110.58 50.16 0.82 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.833 0.825 . . . . 0.0 110.669 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.5 p -73.33 -17.1 61.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.1 121.76 80.92 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.272 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.75 -22.62 11.71 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.187 1.925 . . . . 0.0 112.658 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 36.6 ptt-85 -76.73 -19.2 57.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.173 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 5.3 t -70.98 153.73 42.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.392 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.9 ttm-85 -59.07 -43.76 91.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.204 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -96.52 126.47 41.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.231 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -118.97 144.58 46.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.658 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.645 179.984 . . . . . . . . 0 0 . 1 stop_ save_