data_6u7u_residue ############################ # Computer software used # ############################ 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 6u7u _Structure_validation_residue.Date_analyzed 2020-04-17 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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.42 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.493 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.493 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.588 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.425 ' HZ2' ' HB3' ' A' ' 5' ' ' LYS . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.407 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.445 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.421 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.493 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.493 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.493 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . 0.493 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.588 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.425 ' HZ2' ' HB3' ' A' ' 5' ' ' LYS . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.407 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.448 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.445 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . 0.448 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.421 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.477 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 10' ' ' ARG . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 10' ' ' ARG . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.476 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.602 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HB ' ' A' ' 4' ' ' THR . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.477 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 10' ' ' ARG . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.508 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' WMH . . . . . 0.508 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 10' ' ' ARG . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.476 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.602 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HB ' ' A' ' 4' ' ' THR . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' WMH . . . . . 0.465 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.477 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 10' ' ' ARG . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 10' ' ' ARG . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.476 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.602 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HB ' ' A' ' 4' ' ' THR . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.933 0 N-CA-C 112.674 -0.17 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -64.93 117.88 8.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.023 0.439 . . . . 0.0 111.686 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.36 133.1 47.24 Favored 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 124.109 0.964 . . . . 0.0 109.116 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.8 p -82.49 142.53 31.8 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -85.54 -30.3 23.5 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.7 p -95.87 162.39 13.6 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.065 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -75.37 146.79 81.72 Favored Pre-proline 0 C--N 1.313 -1.002 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.405 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -72.94 137.24 48.37 Favored 'Cis proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.433 -1.486 . . . . 0.0 110.949 -3.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.31 101.05 0.69 Allowed 'Trans proline' 0 C--O 1.243 0.763 0 C-N-CA 121.924 1.749 . . . . 0.0 110.116 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -115.95 132.75 56.56 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.385 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.28 140.7 52.6 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.225 0.536 . . . . 0.0 110.329 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.59 143.05 27.77 Favored Pre-proline 0 C--N 1.283 -2.302 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.8 -17.11 22.13 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 123.763 2.975 . . . . 0.0 114.633 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.313 -0.998 0 C-N-CA 122.569 0.347 . . . . 0.0 111.591 177.683 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.965 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -155.86 112.44 3.15 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 120.97 0.414 . . . . 0.0 110.466 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.88 135.79 46.94 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.626 1.17 . . . . 0.0 109.198 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.4 p -84.45 144.58 28.66 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.038 0.447 . . . . 0.0 110.941 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -81.47 -37.62 27.68 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.6 p -84.11 157.47 21.72 Favored 'General case' 0 C--O 1.262 1.758 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.463 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 pt -84.69 153.75 61.33 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.903 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -72.28 148.2 90.66 Favored 'Cis proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.894 -1.294 . . . . 0.0 110.333 -2.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -60.46 101.4 0.17 Allowed 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 122.359 2.04 . . . . 0.0 111.484 176.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -102.68 110.17 22.02 Favored 'General case' 0 C--N 1.292 -1.927 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -178.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.46 134.68 55.08 Favored 'General case' 0 CA--C 1.501 -0.91 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.721 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -126.04 146.27 55.08 Favored Pre-proline 0 C--N 1.292 -1.895 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.12 14.49 0.35 Allowed 'Trans proline' 0 N--CA 1.49 1.296 0 C-N-CA 123.994 3.129 . . . . 0.0 114.787 -174.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--N 1.294 -1.828 0 CA-C-O 121.008 0.432 . . . . 0.0 110.311 177.426 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.033 0 CA-C-O 120.116 -0.269 . . . . 0.0 113.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 18.7 mmt180 -117.66 139.33 51.16 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.37 135.02 28.18 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.02 0.528 . . . . 0.0 109.582 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.8 p -84.7 133.88 34.37 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-O 121.294 0.569 . . . . 0.0 112.229 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -81.65 -23.65 36.81 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.037 173.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.4 p -82.63 135.91 34.92 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.2 pt -82.11 151.9 67.35 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.33 -178.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.95 152.07 92.49 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.113 -1.203 . . . . 0.0 112.273 -0.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.03 104.97 0.63 Allowed 'Trans proline' 0 C--O 1.24 0.601 0 C-N-CA 122.674 2.249 . . . . 0.0 111.819 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -110.03 125.89 53.4 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.62 150.06 43.16 Favored 'General case' 0 N--CA 1.429 -1.523 0 C-N-CA 119.846 -0.741 . . . . 0.0 110.367 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 80.6 m-85 -121.8 139.19 29.7 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.129 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.32 -3.15 4.72 Favored 'Trans proline' 0 N--CA 1.482 0.847 0 C-N-CA 124.172 3.248 . . . . 0.0 115.596 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.315 -0.921 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.744 177.116 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.941 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -147.06 117.04 7.23 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.3 133.17 34.67 Favored 'General case' 0 C--N 1.289 -2.033 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.3 p -88.56 129.42 35.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-O 121.069 0.462 . . . . 0.0 109.863 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -81.17 -33.32 33.15 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 p -76.1 141.34 42.01 Favored 'General case' 0 N--CA 1.413 -2.314 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.259 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -77.43 145.07 71.38 Favored Pre-proline 0 C--N 1.31 -1.134 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.282 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.477 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 67.8 Cg_endo -73.87 139.92 64.31 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.994 -1.253 . . . . 0.0 112.764 -0.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.8 Cg_exo -74.75 103.87 1.79 Allowed 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 122.628 2.218 . . . . 0.0 111.185 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -114.98 133.22 56.21 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.72 148.77 44.18 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 120.872 0.368 . . . . 0.0 110.542 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -134.76 148.54 67.57 Favored Pre-proline 0 C--N 1.298 -1.639 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.899 -177.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.15 10.86 0.62 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 123.645 2.897 . . . . 0.0 115.106 -173.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.437 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.908 0 N-CA-C 112.389 -0.284 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 20.6 mmt180 -131.1 144.51 51.47 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.71 133.65 15.96 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 123.099 0.56 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.7 p -85.92 129.69 34.76 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 121.501 0.667 . . . . 0.0 110.661 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.3 -2.49 57.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -111.28 152.6 27.0 Favored 'General case' 0 N--CA 1.414 -2.271 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.384 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.1 pt -74.86 142.79 77.08 Favored Pre-proline 0 C--N 1.31 -1.111 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 60.3 Cg_endo -77.26 138.57 54.05 Favored 'Cis proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.312 -1.537 . . . . 0.0 111.222 -2.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 16.9 Cg_exo -68.18 106.67 1.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.131 1.887 . . . . 0.0 111.045 178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -126.5 148.66 49.66 Favored 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.28 152.83 50.17 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.2 m-85 -123.06 139.52 31.71 Favored Pre-proline 0 C--N 1.288 -2.085 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 47.3 Cg_exo -56.38 -22.67 42.91 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.853 3.035 . . . . 0.0 115.143 -173.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 121.152 0.501 . . . . 0.0 111.024 -179.451 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.569 0 CA-C-O 121.023 0.235 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 14' ' ' ASP . 24.9 mtp-105 -132.16 135.94 46.73 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 120.979 0.419 . . . . 0.0 111.131 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.03 149.83 50.2 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 124.325 1.05 . . . . 0.0 109.689 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.2 p -85.91 143.78 28.02 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -88.47 -13.18 40.96 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 p -79.81 149.25 31.1 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.764 177.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 pt -94.98 137.8 22.19 Favored Pre-proline 0 C--N 1.313 -0.997 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.53 145.05 82.88 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.972 -1.261 . . . . 0.0 111.913 -0.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.66 110.93 2.86 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.295 1.997 . . . . 0.0 111.929 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -100.28 131.21 46.34 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.76 135.08 54.99 Favored 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 119.756 -0.777 . . . . 0.0 109.678 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -110.77 142.4 26.09 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.501 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -63.68 -3.12 5.07 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.967 3.111 . . . . 0.0 115.074 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 2' ' ' ARG . 8.9 p-10 . . . . . 0 C--N 1.316 -0.882 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.356 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -114.45 109.15 17.86 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.19 133.48 56.0 Favored 'General case' 0 C--N 1.283 -2.309 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.3 p -77.96 132.65 37.95 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.94 0.4 . . . . 0.0 111.965 -177.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -82.93 -26.92 30.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -88.51 167.56 13.33 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.5 pt -86.66 146.86 42.4 Favored Pre-proline 0 C--N 1.306 -1.286 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.409 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -86.7 154.59 48.2 Favored 'Cis proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.973 -1.261 . . . . 0.0 111.553 -2.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.46 105.55 1.62 Allowed 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.48 2.12 . . . . 0.0 111.743 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 10' ' ' ARG . 31.5 mmt180 -122.18 133.42 54.73 Favored 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.41 142.44 47.12 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 120.258 -0.577 . . . . 0.0 110.415 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -118.99 145.25 37.54 Favored Pre-proline 0 C--N 1.289 -2.054 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.091 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -42.36 -41.89 7.64 Favored 'Trans proline' 0 C--N 1.359 1.11 1 C-N-CA 125.313 4.009 . . . . 0.0 116.44 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.205 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 21.2 ttm180 -152.06 120.02 6.21 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.46 133.59 45.32 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-O 120.752 0.311 . . . . 0.0 110.805 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -90.14 142.08 28.06 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -86.87 -18.06 31.8 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.044 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 p -72.85 135.95 45.25 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.887 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.8 mt -94.96 138.71 22.01 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 130.42 16.16 Favored 'Cis proline' 0 C--N 1.363 1.33 0 C-N-CA 124.572 -1.012 . . . . 0.0 111.713 -0.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.508 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 60.3 Cg_endo -71.12 135.2 26.74 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 122.461 2.107 . . . . 0.0 111.796 -176.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -111.23 119.8 40.14 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.99 126.06 54.33 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-O 121.508 0.671 . . . . 0.0 110.473 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.483 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 32.9 m-85 -90.9 150.62 42.32 Favored Pre-proline 0 C--N 1.277 -2.587 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.456 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 16.9 Cg_exo -67.65 -11.33 31.73 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.934 2.423 . . . . 0.0 113.399 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.319 -0.735 0 O-C-N 122.064 -0.398 . . . . 0.0 111.368 -179.415 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . 0.508 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.812 0 CA-C-O 120.242 -0.199 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -69.57 121.7 17.6 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.26 137.05 37.11 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 124.162 0.985 . . . . 0.0 110.332 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 37.5 p -77.26 145.63 37.39 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 123.459 0.475 . . . . 0.0 110.764 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -83.51 -25.41 31.1 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 p -107.26 166.09 10.89 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.855 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.7 pt -92.14 152.49 42.69 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.599 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 56.2 Cg_endo -69.86 143.39 73.92 Favored 'Cis proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.0 -1.25 . . . . 0.0 111.689 0.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.5 Cg_exo -64.1 114.15 2.51 Favored 'Trans proline' 0 C--O 1.245 0.866 0 C-N-CA 122.525 2.15 . . . . 0.0 111.615 179.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 10' ' ' ARG . 16.2 tpt180 -117.19 112.12 20.4 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -121.56 144.28 48.82 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-O 121.625 0.726 . . . . 0.0 111.61 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -119.5 152.28 52.76 Favored Pre-proline 0 C--N 1.295 -1.792 0 CA-C-N 114.493 -1.23 . . . . 0.0 109.469 -177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -65.13 -9.47 21.92 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.526 2.818 . . . . 0.0 114.11 -176.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--N 1.319 -0.736 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.399 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.476 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 39.6 mmt180 -61.92 130.31 45.02 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' ARG . . . -144.97 133.8 22.36 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.2 p -90.58 148.03 22.95 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.3 ptmm? -86.06 -25.18 26.02 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.6 p -79.19 143.98 34.87 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.166 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.3 pt -84.88 141.83 38.45 Favored Pre-proline 0 C--N 1.317 -0.812 0 C-N-CA 121.391 -0.124 . . . . 0.0 110.86 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.9 Cg_exo -76.62 132.94 29.08 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 124.196 -1.168 . . . . 0.0 110.804 -2.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.7 Cg_exo -65.61 120.12 7.26 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.306 2.004 . . . . 0.0 110.88 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 3' ' ' ALA . 33.5 mmt180 -99.02 129.28 45.29 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.85 143.89 50.07 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.905 -0.718 . . . . 0.0 110.338 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 63.2 m-85 -122.84 137.59 28.27 Favored Pre-proline 0 C--N 1.276 -2.616 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 83.9 Cg_exo -53.21 -19.55 12.6 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 124.119 3.213 . . . . 0.0 115.481 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD2' ' HG2' ' A' ' 2' ' ' ARG . 4.2 p30 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.67 0.271 . . . . 0.0 110.573 177.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.091 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.602 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.3 mmp_? -63.7 126.72 28.48 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-O 121.197 0.522 . . . . 0.0 112.132 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.98 133.76 21.17 Favored 'General case' 0 C--N 1.29 -2.008 0 C-N-CA 124.931 1.292 . . . . 0.0 108.612 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.5 p -89.22 139.25 30.67 Favored 'General case' 0 N--CA 1.421 -1.915 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -101.65 10.75 39.86 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 122.219 1.009 . . . . 0.0 109.55 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.4 p -117.77 175.94 5.42 Favored 'General case' 0 N--CA 1.425 -1.718 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.638 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 30.9 pt -85.43 134.63 39.92 Favored Pre-proline 0 C--N 1.31 -1.147 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.779 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -90.07 158.49 32.95 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.082 -1.216 . . . . 0.0 110.986 -1.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.65 100.94 0.52 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.313 2.008 . . . . 0.0 110.499 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -115.34 116.29 28.03 Favored 'General case' 0 C--N 1.292 -1.926 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.12 151.22 42.29 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.593 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -130.59 151.73 79.19 Favored Pre-proline 0 C--N 1.3 -1.572 0 C-N-CA 124.322 1.049 . . . . 0.0 108.209 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -66.27 -7.46 17.5 Favored 'Trans proline' 0 N--CA 1.484 0.921 0 C-N-CA 123.588 2.858 . . . . 0.0 114.569 -175.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.614 0.721 . . . . 0.0 109.136 179.582 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.403 0 N-CA-C 113.852 0.301 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 77.6 mtp180 -125.72 134.59 51.73 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 117.223 0.512 . . . . 0.0 110.54 -178.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.94 133.96 15.95 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 124.506 1.122 . . . . 0.0 108.921 175.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.3 p -90.52 129.79 36.64 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.709 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -76.56 -8.91 58.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.783 0.801 . . . . 0.0 108.883 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -94.34 147.43 23.22 Favored 'General case' 0 N--CA 1.41 -2.446 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.092 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.4 pt -91.56 141.62 26.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.4 Cg_endo -74.0 142.58 75.19 Favored 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.598 -1.418 . . . . 0.0 112.615 1.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.7 Cg_exo -65.97 106.42 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.934 0 C-N-CA 122.684 2.256 . . . . 0.0 111.543 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -104.43 116.12 31.56 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.66 147.72 43.49 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.601 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 86.7 m-85 -132.34 137.08 29.16 Favored Pre-proline 0 C--N 1.288 -2.099 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -65.41 -4.43 9.41 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 C-N-CA 124.094 3.196 . . . . 0.0 114.609 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.921 179.063 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 CA-C-O 120.762 0.09 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -153.64 144.87 22.99 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.83 134.36 26.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 124.002 0.921 . . . . 0.0 110.106 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 59.4 p -84.64 125.44 32.48 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -84.52 -17.83 37.71 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 175.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 p -75.22 143.31 43.18 Favored 'General case' 0 N--CA 1.42 -1.955 0 CA-C-N 114.13 -1.396 . . . . 0.0 107.812 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.8 pt -76.35 138.94 67.66 Favored Pre-proline 0 C--N 1.299 -1.627 0 O-C-N 123.261 0.35 . . . . 0.0 110.168 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.3 Cg_endo -82.42 142.49 49.41 Favored 'Cis proline' 0 C--O 1.245 0.848 0 C-N-CA 123.77 -1.346 . . . . 0.0 110.868 -0.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 24.3 Cg_exo -65.13 103.19 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.218 1.945 . . . . 0.0 110.918 177.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -111.32 131.2 55.34 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.31 134.99 54.17 Favored 'General case' 0 N--CA 1.414 -2.227 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.79 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -111.34 131.05 22.45 Favored Pre-proline 0 C--N 1.277 -2.555 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.838 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -63.8 -0.92 2.9 Favored 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.853 3.035 . . . . 0.0 114.715 -175.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.315 -0.907 0 CA-C-O 121.388 0.613 . . . . 0.0 109.908 176.659 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.325 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 2.9 tpm_? -100.29 127.17 46.64 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.21 134.48 25.96 Favored 'General case' 0 C--N 1.288 -2.077 0 C-N-CA 124.52 1.128 . . . . 0.0 109.41 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 p -90.27 127.93 36.28 Favored 'General case' 0 N--CA 1.416 -2.161 0 O-C-N 123.692 0.62 . . . . 0.0 109.631 177.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -72.66 -22.64 60.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -105.5 156.03 18.6 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.206 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 pt -75.68 147.87 81.89 Favored Pre-proline 0 N--CA 1.433 -1.298 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.564 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 9.1 Cg_exo -73.33 130.66 20.77 Favored 'Cis proline' 0 C--O 1.245 0.836 0 C-N-CA 123.766 -1.348 . . . . 0.0 110.752 -0.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 7.8 Cg_exo -71.44 99.74 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.205 1.937 . . . . 0.0 110.39 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -109.79 121.28 44.88 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.62 136.75 52.71 Favored 'General case' 0 N--CA 1.418 -2.044 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.831 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 84.2 m-85 -123.54 142.18 38.32 Favored Pre-proline 0 C--N 1.285 -2.235 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.65 -175.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.37 -1.6 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.6 3.533 . . . . 0.0 116.536 -175.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.32 -0.709 0 O-C-N 121.884 -0.51 . . . . 0.0 109.846 178.557 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.631 -0.588 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 77.6 ttt180 -98.21 113.05 24.85 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.84 136.55 38.87 Favored 'General case' 0 C--N 1.299 -1.598 0 C-N-CA 123.389 0.675 . . . . 0.0 111.276 -178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.0 p -86.99 141.82 28.4 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.14 -38.24 15.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.456 0.646 . . . . 0.0 109.401 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.4 p -89.73 161.69 15.93 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.909 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 pt -70.84 145.8 92.42 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.276 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 7.4 Cg_exo -77.23 132.86 28.6 Favored 'Cis proline' 0 C--O 1.249 1.063 0 C-N-CA 123.953 -1.27 . . . . 0.0 111.035 -2.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_exo -74.75 102.76 1.61 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.17 1.913 . . . . 0.0 110.461 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -119.95 124.31 45.67 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.99 144.19 48.64 Favored 'General case' 0 CA--C 1.491 -1.308 0 CA-C-O 121.342 0.591 . . . . 0.0 111.487 -175.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 68.4 m-85 -122.63 152.04 61.17 Favored Pre-proline 0 C--N 1.29 -2.015 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.292 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.53 0.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 123.983 3.122 . . . . 0.0 115.35 -174.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.309 -1.178 0 CA-C-O 121.436 0.636 . . . . 0.0 109.842 178.682 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.261 0 CA-C-O 120.292 -0.171 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.08 137.24 51.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.168 0.508 . . . . 0.0 111.181 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.79 134.97 43.52 Favored 'General case' 0 C--N 1.278 -2.533 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -74.09 146.15 43.84 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 178.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -94.08 -36.06 12.27 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -75.13 143.7 43.19 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.521 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.8 pt -82.64 138.9 43.88 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.615 -179.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 136.59 36.19 Favored 'Cis proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.423 0.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HB ' ' A' ' 4' ' ' THR . 55.2 Cg_endo -71.43 129.03 15.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.046 1.83 . . . . 0.0 112.077 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -109.75 142.5 40.88 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.17 127.83 50.5 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.738 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -99.44 148.5 34.77 Favored Pre-proline 0 C--N 1.275 -2.633 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.745 -172.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -60.58 -17.9 51.51 Favored 'Trans proline' 0 N--CA 1.481 0.772 0 C-N-CA 123.555 2.837 . . . . 0.0 114.173 -176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 CA-C-O 121.383 0.611 . . . . 0.0 110.24 -179.827 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.414 0 N-CA-C 111.622 -0.591 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 79.7 ttt180 -156.5 122.21 4.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -140.75 133.39 28.74 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 123.216 0.607 . . . . 0.0 109.599 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.0 p -78.78 130.15 35.43 Favored 'General case' 0 C--N 1.317 -0.819 0 O-C-N 123.152 0.283 . . . . 0.0 110.571 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -80.65 70.98 7.51 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.574 1.178 . . . . 0.0 110.32 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p -161.65 167.28 25.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.415 -176.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -121.9 126.86 26.21 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 175.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -71.55 140.18 63.56 Favored 'Cis proline' 0 C--O 1.252 1.177 0 C-N-CA 124.681 -0.966 . . . . 0.0 112.615 0.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 61.0 Cg_endo -80.11 124.07 5.33 Favored 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 122.205 1.937 . . . . 0.0 111.564 178.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -101.04 129.04 46.83 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.95 159.15 34.9 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.613 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 98.8 m-85 -128.07 143.28 47.31 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 23.7 Cg_exo -64.87 -12.3 33.65 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.932 2.421 . . . . 0.0 114.413 -173.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--N 1.324 -0.511 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.549 -179.846 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . 0.465 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.687 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -153.14 142.58 21.7 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.12 138.62 45.35 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.7 p -72.16 132.92 44.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.225 0.536 . . . . 0.0 111.221 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -87.48 -21.68 25.37 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.884 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -100.87 154.44 18.66 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.254 176.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -71.63 151.46 93.61 Favored Pre-proline 0 C--N 1.314 -0.938 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -79.76 159.97 87.7 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.577 -1.426 . . . . 0.0 112.028 -1.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.62 112.6 1.83 Allowed 'Trans proline' 0 C--O 1.24 0.595 0 C-N-CA 122.738 2.292 . . . . 0.0 110.967 176.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -139.93 133.59 30.37 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.11 149.3 43.78 Favored 'General case' 0 N--CA 1.419 -2.024 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.812 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -108.5 139.21 20.59 Favored Pre-proline 0 C--N 1.28 -2.453 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.083 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.12 -18.24 42.85 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.904 3.069 . . . . 0.0 114.25 -175.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--N 1.316 -0.888 0 CA-C-O 120.988 0.423 . . . . 0.0 110.677 -178.605 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.211 0 N-CA-C 112.552 -0.219 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -169.09 128.15 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 C-N-CA 123.081 0.552 . . . . 0.0 109.816 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.13 133.76 25.09 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 124.039 0.936 . . . . 0.0 109.9 175.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 9' ' ' PRO . 39.1 p -94.15 123.92 37.84 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-O 121.251 0.548 . . . . 0.0 109.608 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -83.99 -5.24 59.19 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.8 0.809 . . . . 0.0 109.083 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -89.89 166.88 13.24 Favored 'General case' 0 N--CA 1.413 -2.316 0 CA-C-N 114.409 -1.269 . . . . 0.0 109.118 176.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.4 pt -102.51 135.16 19.59 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -83.2 148.46 63.03 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 C-N-CA 124.054 -1.228 . . . . 0.0 112.521 -0.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HA ' ' OG1' ' A' ' 4' ' ' THR . 59.5 Cg_endo -75.59 125.68 9.09 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.583 2.189 . . . . 0.0 112.02 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 mmm180 -123.24 122.05 37.4 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.59 144.69 45.95 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.453 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -123.55 133.0 24.29 Favored Pre-proline 0 C--N 1.295 -1.774 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.832 -178.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -62.54 -18.74 65.11 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.204 2.603 . . . . 0.0 113.337 -178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.842 0.353 . . . . 0.0 110.731 178.173 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.078 0 N-CA-C 113.63 0.212 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 25.7 ttt85 -160.37 105.14 1.47 Allowed 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 176.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.54 133.15 54.03 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.9 p -96.31 144.54 26.39 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 120.977 0.418 . . . . 0.0 110.883 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -93.39 -3.01 54.02 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.339 0.59 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.5 p -81.62 163.37 22.61 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.691 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.5 mm -105.18 131.54 21.67 Favored Pre-proline 0 C--N 1.308 -1.198 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -177.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -79.53 143.67 69.27 Favored 'Cis proline' 0 C--N 1.347 0.499 0 C-N-CA 124.289 -1.13 . . . . 0.0 111.431 -0.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.03 118.85 5.77 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.205 1.937 . . . . 0.0 111.484 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -112.45 130.74 55.88 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -124.78 149.68 47.1 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.951 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -128.39 138.38 32.91 Favored Pre-proline 0 C--N 1.298 -1.643 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.934 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -41.46 -55.41 2.25 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 125.251 3.967 . . . . 0.0 116.275 -175.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -173.152 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_